Compound Identification
SMILES
OC(=O)C1=CC(NC(=O)COC2=CC=C(NC3=C(C=C(C=C3)[N+]([O-])=O)[N+]([O-])=O)C=C2)=CC=C1
InChIKey
InChIKey=IOHNRFBAMBRPNV-UHFFFAOYSA-N
Formula
C21H16N4O8
Mass
452.379
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
Dinitroanilines Aminophenyl ethers Anilides Benzoic acids Nitrobenzenes Benzoyl derivatives N-arylamides Nitroaromatic compounds Phenoxy compounds Alkyl aryl ethers Primary aromatic amines Secondary carboxylic acid amides Amino acids Secondary amines Carboxylic acids Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides Organic salts Organic cations
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Acylaminobenzoic acid or derivatives - Dinitroaniline - Aminophenyl ether - Benzoic acid - Nitrobenzene - Anilide - Phenoxy compound - Nitroaromatic compound - Benzoyl - Phenol ether - Aniline or substituted anilines - N-arylamide - Alkyl aryl ether - Primary aromatic amine - Amino acid or derivatives - Carboxamide group - C-nitro compound - Amino acid - Organic nitro compound - Secondary carboxylic acid amide - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Carboxylic acid - Ether - Organic oxoazanium - Secondary amine - Organic oxide - Organic salt - Organic nitrogen compound - Carbonyl group - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxygen compound - Amine - Organic cation - Aromatic homomonocyclic 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