Compound Identification
SMILES
CNC1=C(C=C(C=C1)C(=O)O[C@H](C)C(=O)NC1=CC=C(C=C1)C(N)=O)[N+]([O-])=O
InChIKey
InChIKey=LLMAUZAKLQFPFL-SNVBAGLBSA-N
Formula
C18H18N4O6
Mass
386.364
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
Nitrobenzoic acids and derivatives Aminobenzoic acids and derivatives Benzoic acid esters Anilides Benzamides Nitrobenzenes Aniline and substituted anilines Benzoyl derivatives N-arylamides Nitroaromatic compounds Phenylalkylamines Secondary alkylarylamines Amino acids and derivatives Carboxylic acid esters Secondary carboxylic acid amides Primary carboxylic acid amides Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Hydrocarbon derivatives Carbonyl compounds Organic zwitterions Organic oxides Organic salts
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Acylaminobenzoic acid or derivatives - Nitrobenzoate - Aminobenzoic acid or derivatives - Benzoate ester - Benzamide - Nitrobenzene - Anilide - Nitroaromatic compound - Benzoyl - Phenylalkylamine - Aniline or substituted anilines - N-arylamide - Secondary aliphatic/aromatic amine - Secondary carboxylic acid amide - Amino acid or derivatives - Primary carboxylic acid amide - Carboxamide group - Carboxylic acid ester - Organic nitro compound - C-nitro compound - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Secondary amine - Carboxylic acid derivative - Organic oxoazanium - Organic zwitterion - Organic salt - Organonitrogen compound - Organooxygen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Amine - 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