293472 <common-name>Diethyl-methyl-[2-[(2-nitrobenzoyl)amino]ethyl]azanium</common-name> <description>Diethyl-methyl-[2-[(2-nitrobenzoyl)amino]ethyl]azanium belongs to the nitrobenzenes, a subclass of benzene and substituted derivatives within the organic compounds. This benzenoid compound has the formula C14H22N3O3+ and an average molecular weight of 280.34 g/mol.</description> <cas nil="true"/> <pubchem-id>121266</pubchem-id> <chemical-formula>C14H22N3O3+</chemical-formula> <weight>280.34</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">2026-08-28T08:50:47Z</created-at> <updated-at type="dateTime">2026-08-28T08:50:47Z</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>CC[N+](C)(CC)CCNC(=O)C1=CC=CC=C1[N+](=O)[O-]</moldb-smiles> <moldb-formula>C14H22N3O3+</moldb-formula> <moldb-inchi>InChI=1S/C14H21N3O3/c1-4-17(3,5-2)11-10-15-14(18)12-8-6-7-9-13(12)16(19)20/h6-9H,4-5,10-11H2,1-3H3/p+1</moldb-inchi> <moldb-inchikey>VRHYWOIBSRJDIW-UHFFFAOYSA-O</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">280.1661166</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>1</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>CHEM289365</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>Diethyl-methyl-[2-[(2-nitrobenzoyl)amino]ethyl]azanium</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>Benzenoids</superklass> <klass>Benzene and substituted derivatives</klass> <subklass>Nitrobenzenes</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0244982</sync-id> <structure-inchikey>VRHYWOIBSRJDIW-UHFFFAOYSA-O</structure-inchikey> <structure-fingerprint>800000000000000000800000000800000000000800000004000000000000000000000002000000000000002000010000000002000000000000000202000000000000000000000000000002000008000020001000000000001800000000400000000000010000000200000000000000000040000040000020008000000000000000020040000000800000000000000080000000001100000000000000000000000000000400000000000000080000000000000001000000000000000000000000000000000000000000000000000000000000000000000000000200000000000000000000000000000040000000000400000000001000000100000000000000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAAUAAAAFAAAAIABBgBgAAAAAQMGAGAAAAAC AgcgIgAAAAEEBgBgAAAAAQMGAGAAAAACAgYAYAAAAAEDBgBgAAAAAgIGAGAA AAACAgcAaAAAAAMCAQYAKAAAAAMECAAoAAAAAwIGQCgAAAADBAZAaAAAAAMD AQZAaAAAAAMDAQZAaAAAAAMDAQZAaAAAAAMDAQZAKAAAAAMEByAqAAAAAQME CAAoAAAAAwIIICoAAAD/AwELAAEAAQIAAgMAAgQABAUAAgYABgcABwgACAkg CQooAgkLIAsMaAwMDWgMDQ5oDA4PaAwPEGgMEBEgERIoAhETIBALaAxCAQAA AAYLEA8ODQwXBAAAAAAAAAAW </structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:05:23Z</structure-indexed-at> </compound>