Structure Information
Structure

Compound Identification

SMILES

OC(CNC1=CC=C(C=C1)C(=O)NNC(=O)CO[N+]([O-])=O)CN1C(=O)\C(SC1=NC1=CC=CC=C1)=C\C1=CC=C(O)C=C1

InChIKey

InChIKey=LDTPGUBUVSYFHT-AKJIXFPRSA-N

Formula

C28H26N6O8S

Mass

606.61

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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 - Benzoyl - Phenylalkylamine - Aniline or substituted anilines - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Secondary aliphatic/aromatic amine - Organic nitrate - Thiazolidine - Alkyl nitrate - 1,2-aminoalcohol - Amino acid or derivatives - Carboxylic acid hydrazide - Isothiourea - Organic nitric acid or derivatives - Secondary alcohol - Tertiary amine - Organic nitro compound - Secondary amine - Azacycle - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Organic salt - Organic oxide - Alcohol - Amine - Organic nitrogen compound - Organic oxygen compound - Carbonyl group - Organic zwitterion - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - 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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