Compound Identification
SMILES
CC(=O)NC1=C(C=C(C=C1)C(O)=O)N1C=C(N=C1N)C1=CC(=CC=C1)[N+]([O-])=O
InChIKey
InChIKey=KECCQQNAJZKSBP-UHFFFAOYSA-N
Formula
C18H15N5O5
Mass
381.348
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzoic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Acylaminobenzoic acid and derivatives
Alternative Parents
Phenylimidazoles Acetanilides Benzoic acids N-acetylarylamines Nitrobenzenes 1,2,4-trisubstituted imidazoles Benzoyl derivatives Imidazolyl carboxylic acids and derivatives Nitroaromatic compounds N-substituted imidazoles Aminoimidazoles Heteroaromatic compounds Acetamides Amino acids Secondary carboxylic acid amides Carboxylic acids Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic oxoazanium compounds Primary amines Hydrocarbon derivatives Carbonyl compounds Organic zwitterions Organic oxides Organic salts
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Acylaminobenzoic acid or derivatives - 4-phenylimidazole - 1-phenylimidazole - 5-phenylimidazole - Acetanilide - Benzoic acid - Nitrobenzene - Anilide - N-acetylarylamine - 1,2,4-trisubstituted-imidazole - Benzoyl - Imidazolyl carboxylic acid derivative - N-arylamide - Trisubstituted imidazole - Nitroaromatic compound - N-substituted imidazole - Aminoimidazole - Azole - Imidazole - Heteroaromatic compound - Acetamide - Secondary carboxylic acid amide - Amino acid - Carboxamide group - Organic nitro compound - C-nitro compound - Amino acid or derivatives - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organoheterocyclic compound - Organic 1,3-dipolar compound - Organic oxoazanium - Azacycle - Carboxylic acid derivative - Carboxylic acid - Primary amine - Amine - Organonitrogen compound - Carbonyl group - Hydrocarbon derivative - Organooxygen compound - Organic nitrogen compound - Organic oxide - Organic oxygen compound - Organic salt - Organic zwitterion - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as acylaminobenzoic acid and derivatives. These are derivatives of amino benzoic acid derivatives where the amine group is N-acylated.
External Descriptors
Not available