Structure Information
Structure

Compound Identification

SMILES

CNC1=C(C=C(C=C1)C(=O)NC1=NC(=C(C)S1)C1=CC=C(OC)C=C1)[N+]([O-])=O

InChIKey

InChIKey=AFPKJFXLHJIHLI-UHFFFAOYSA-N

Formula

C19H18N4O4S

Mass

398.44

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Benzoic acids and derivatives

Intermediate Tree Nodes

Not available

Direct Parent

Aminobenzoic acids and derivatives

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Aminobenzoic acid or derivatives - Nitrobenzene - Benzamide - 2,4,5-trisubstituted 1,3-thiazole - Anisole - Methoxybenzene - Phenylalkylamine - Aniline or substituted anilines - Benzoyl - Phenol ether - Nitroaromatic compound - Phenoxy compound - Alkyl aryl ether - Secondary aliphatic/aromatic amine - Heteroaromatic compound - Azole - Thiazole - Amino acid or derivatives - Organic nitro compound - Carboxamide group - C-nitro compound - Secondary carboxylic acid amide - Allyl-type 1,3-dipolar organic compound - Secondary amine - Propargyl-type 1,3-dipolar organic compound - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Ether - Organic oxoazanium - Organic 1,3-dipolar compound - Organic oxide - Amine - Hydrocarbon derivative - Organic nitrogen compound - Organic salt - Organic zwitterion - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as aminobenzoic acids and derivatives. These are benzoic acids (or derivative thereof) containing an amine group attached to the benzene moiety.

External Descriptors

Not available

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