Compound Identification
SMILES
CC1=C(C=CC(=C1)N(CCC#N)CCC#N)C(=NNC1=CC=C(C=C1)C(O)=O)N=NC(=O)C1=CC=CC=C1
InChIKey
InChIKey=XXISHGCPZYFFOY-UHFFFAOYSA-N
Formula
C28H25N7O3
Mass
507.554
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Benzenoids
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Class
Benzene and substituted derivatives
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Subclass
Benzoic acids and derivatives
- Level 5 Benzoic acids
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Subclass
Benzoic acids and derivatives
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Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzoic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Benzoic acids
Alternative Parents
Phenylhydrazines Dialkylarylamines Benzoyl derivatives Aniline and substituted anilines Aminotoluenes Formazans Azo compounds Amino acids Propargyl-type 1,3-dipolar organic compounds Nitriles Hydrazones Carboxylic acids Organooxygen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Benzoic acid - Benzoyl - Phenylhydrazine - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Aniline or substituted anilines - Aminotoluene - Toluene - Formazan - Amino acid - Azo compound - Amino acid or derivatives - Tertiary amine - Carboxylic acid derivative - Carboxylic acid - Organic 1,3-dipolar compound - Hydrazone - Carbonitrile - Nitrile - Propargyl-type 1,3-dipolar organic compound - Organic oxide - Cyanide - Organic nitrogen compound - Hydrocarbon derivative - Amine - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as benzoic acids. These are organic Compounds containing a benzene ring which bears at least one carboxyl group.
External Descriptors
Not available