<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">306006</id>
  <title nil="true"/>
  <common-name>Methyl 4-[(e)-[(2-anilino-2-oxoacetyl)hydrazinylidene]methyl]benzoate</common-name>
  <description>Methyl 4-[(e)-[(2-anilino-2-oxoacetyl)hydrazinylidene]methyl]benzoate belongs to the amino acids, peptides, and analogues, a subclass of carboxylic acids and derivatives within the organic compounds. This organic acid derivative has the formula C17H15N3O4 and an average molecular weight of 325.32 g/mol.</description>
  <cas>357207-67-1</cas>
  <pubchem-id>9690948</pubchem-id>
  <chemical-formula>C17H15N3O4</chemical-formula>
  <weight>325.32</weight>
  <appearance nil="true"/>
  <melting-point nil="true"/>
  <boiling-point nil="true"/>
  <density nil="true"/>
  <solubility nil="true"/>
  <specific-gravity nil="true"/>
  <flash-point nil="true"/>
  <vapour-pressure nil="true"/>
  <route-of-exposure nil="true"/>
  <target nil="true"/>
  <mechanism-of-toxicity nil="true"/>
  <metabolism nil="true"/>
  <toxicity nil="true"/>
  <lethaldose nil="true"/>
  <carcinogenicity nil="true"/>
  <use-source nil="true"/>
  <min-risk-level nil="true"/>
  <health-effects nil="true"/>
  <symptoms nil="true"/>
  <treatment nil="true"/>
  <created-at type="dateTime">2026-08-28T23:43:51Z</created-at>
  <updated-at type="dateTime">2026-08-28T23:43:51Z</updated-at>
  <interacting-proteins nil="true"/>
  <wikipedia nil="true"/>
  <uniprot-id nil="true"/>
  <kegg-compound-id nil="true"/>
  <omim-id nil="true"/>
  <chebi-id nil="true"/>
  <biocyc-id nil="true"/>
  <ctd-id nil="true"/>
  <stitch-id nil="true"/>
  <drugbank-id nil="true"/>
  <pdb-id nil="true"/>
  <actor-id nil="true"/>
  <organism nil="true"/>
  <export type="boolean">true</export>
  <metabolizing-proteins nil="true"/>
  <transporting-proteins nil="true"/>
  <moldb-smiles>COC(=O)C1=CC=C(C=C1)C=NNC(=O)C(=O)NC2=CC=CC=C2</moldb-smiles>
  <moldb-formula>C17H15N3O4</moldb-formula>
  <moldb-inchi>InChI=1S/C17H15N3O4/c1-24-17(23)13-9-7-12(8-10-13)11-18-20-16(22)15(21)19-14-5-3-2-4-6-14/h2-11H,1H3,(H,19,21)(H,20,22)/b18-11+</moldb-inchi>
  <moldb-inchikey>UUVJFZGVVXGUDE-WOJGMQOQSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">325.106256</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>2.3</logp>
  <hmdb-id nil="true"/>
  <chembl-id nil="true"/>
  <chemspider-id nil="true"/>
  <structure-image-file-name nil="true"/>
  <structure-image-content-type nil="true"/>
  <structure-image-file-size type="integer" nil="true"/>
  <structure-image-updated-at type="dateTime" nil="true"/>
  <biodb-id nil="true"/>
  <synthesis-reference nil="true"/>
  <structure-image-caption nil="true"/>
  <chemdb-id>CHEM301899</chemdb-id>
  <dsstox-id nil="true"/>
  <toxcast-id nil="true"/>
  <stoff-ident-origin nil="true"/>
  <stoff-ident-id nil="true"/>
  <susdat-id nil="true"/>
  <iupac>Methyl 4-[(e)-[(2-anilino-2-oxoacetyl)hydrazinylidene]methyl]benzoate</iupac>
  <moldb-polar-surface-area nil="true"/>
  <moldb-refractivity nil="true"/>
  <moldb-polarizability nil="true"/>
  <moldb-rotatable-bond-count nil="true"/>
  <moldb-acceptor-count nil="true"/>
  <moldb-donor-count nil="true"/>
  <moldb-pka-strongest-acidic nil="true"/>
  <moldb-pka-strongest-basic nil="true"/>
  <moldb-physiological-charge nil="true"/>
  <moldb-number-of-rings nil="true"/>
  <moldb-alogps-logp nil="true"/>
  <moldb-alogps-logs nil="true"/>
  <moldb-alogps-solubility nil="true"/>
  <kingdom>Organic compounds</kingdom>
  <superklass>Organic acids and derivatives</superklass>
  <klass>Carboxylic acids and derivatives</klass>
  <subklass>Amino acids, peptides, and analogues</subklass>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0257079</sync-id>
  <structure-inchikey>UUVJFZGVVXGUDE-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>40000000000000000000000000000040000000000100000000000000000002000000000402000000004000000004000000000000000000000000000000000000000000000000000002000000000020000000000301000004000000000000000000010000000040000080000000002000080000000000000000000000000000000040000400800100000000000080000000000100200000000000000000000000000000000000000000084000000000000000000000000000000000000000000000000100000000000000000000000000004000100000000200002000000000008000000000001040000000000400000000000000000000000000004000</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ������������������������€���`�������(�������(�������(������@(������@h�������@h�������@(������@h�������@h��������h��������(�������h��������(�������(�������(�������(�������h�������@(������@h�������@h�������@h�������@h�������@h������������ ��(��� ��h���h���h���h��	h��
 
�(��� � �(�� ��(��� �� ��h���h���h���h���h�	�h���h�B������	���������������������</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T05:14:40Z</structure-indexed-at>
</compound>
