Structure Information
Structure

Compound Identification

SMILES

CN=C(NCCNC(C)=O)NC1=CC=C(C=C1)C(=O)OC1=CC2=C(C=C1)C=C(C=C2)C(N)=N

InChIKey

InChIKey=MZPFLMXYBDLKPE-UHFFFAOYSA-N

Formula

C24H26N6O3

Mass

446.511

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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

Aminobenzoic acids and derivatives

Direct Parent

Guanidinobenzoic acids and derivatives

Alternative Parents

Molecular Framework

Aromatic homopolycyclic compounds

Substituents

Guanidinobenzoic acid or derivatives - Benzoate ester - Naphthalene - Phenol ester - Benzoyl - Acetamide - Carboxamide group - Carboxylic acid ester - Guanidine - Secondary carboxylic acid amide - Carboxylic acid derivative - Amidine - Carboxylic acid amidine - Organic 1,3-dipolar compound - Carboximidamide - Propargyl-type 1,3-dipolar organic compound - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Imine - Organic oxide - Organic nitrogen compound - Carbonyl group - Organic oxygen compound - Aromatic homopolycyclic compound

Description

This compound belongs to the class of organic compounds known as guanidinobenzoic acids and derivatives. These are aromatic compounds containing a guanidine group linked to the benzene ring of a benzoic acid (or a derivative thereof).

External Descriptors

Not available

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