Compound Identification
SMILES
OC(=O)C1=CC(NC(=O)C(=CC2=CC=CN2C2=CC(=CC=C2)[N+]([O-])=O)C#N)=CC=C1
InChIKey
InChIKey=ROLWFWOIBITBQF-UHFFFAOYSA-N
Formula
C21H14N4O5
Mass
402.366
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
Phenylpyrroles Anilides Benzoic acids Nitrobenzenes Benzoyl derivatives N-arylamides Nitroaromatic compounds Heteroaromatic compounds Secondary carboxylic acid amides Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Carboxylic acids Organic oxoazanium compounds Nitriles Organic zwitterions Organic salts Hydrocarbon derivatives Organic oxides Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Acylaminobenzoic acid or derivatives - 1-phenylpyrrole - Benzoic acid - Nitrobenzene - Anilide - Nitroaromatic compound - Benzoyl - N-arylamide - Substituted pyrrole - Pyrrole - Heteroaromatic compound - Carboxamide group - C-nitro compound - Secondary carboxylic acid amide - Organic nitro compound - Allyl-type 1,3-dipolar organic compound - Organoheterocyclic compound - Organic 1,3-dipolar compound - Azacycle - Propargyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Carboxylic acid - Carbonitrile - Nitrile - Organic oxoazanium - Organic zwitterion - Cyanide - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organic oxide - Hydrocarbon derivative - Organic oxygen compound - Carbonyl group - Organic salt - 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