<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">13740</id>
  <title nil="true"/>
  <common-name>2-Naphthalenecarboxamide, N-(4-chloro-2,5-dimethoxyphenyl)-3-hydroxy-4-[[2-methoxy-5-[(phenylamino)carbonyl]phenyl]azo]-</common-name>
  <description nil="true"/>
  <cas>5280-68-2</cas>
  <pubchem-id>78936</pubchem-id>
  <chemical-formula>C33H27ClN4O6</chemical-formula>
  <weight>611.0</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">2016-05-19T03:59:04Z</created-at>
  <updated-at type="dateTime">2026-04-17T17:33:09Z</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>COC1=CC(N=C(O)C2=CC3=CC=CC=C3\C(=N\NC3=C(OC)C=CC(=C3)C(O)=NC3=CC=CC=C3)C2=O)=C(OC)C=C1Cl</moldb-smiles>
  <moldb-formula>C33H27ClN4O6</moldb-formula>
  <moldb-inchi>InChI=1S/C33H27ClN4O6/c1-42-27-14-13-20(32(40)35-21-10-5-4-6-11-21)16-26(27)37-38-30-22-12-8-7-9-19(22)15-23(31(30)39)33(41)36-25-18-28(43-2)24(34)17-29(25)44-3/h4-18,37H,1-3H3,(H,35,40)(H,36,41)/b38-30-</moldb-inchi>
  <moldb-inchikey>GBDJNEJIVMFTOJ-ZREQDNEKSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal">611.05</moldb-average-mass>
  <moldb-mono-mass type="decimal">610.1619123</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp nil="true"/>
  <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>CHEM012635</chemdb-id>
  <dsstox-id nil="true"/>
  <toxcast-id nil="true"/>
  <stoff-ident-origin>REACH</stoff-ident-origin>
  <stoff-ident-id>SI00008053</stoff-ident-id>
  <susdat-id nil="true"/>
  <iupac>(4Z)-N-(4-chloro-2,5-dimethoxyphenyl)-4-{2-[2-methoxy-5-(phenyl-C-hydroxycarbonimidoyl)phenyl]hydrazin-1-ylidene}-3-oxo-3,4-dihydronaphthalene-2-carboximidic acid</iupac>
</compound>
