Compound Identification
SMILES
COC1=C(Br)C=C(\C=C2/C=C(N(C2=O)C2=CC=CC(=C2)C([O-])=O)C2=CC=CC=C2)C=C1
InChIKey
InChIKey=LJFHZSVFOKSIOP-XDHOZWIPSA-M
Formula
C25H17BrNO4
Mass
475.319
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
Phenylpyrrolines Benzoic acids Benzoyl derivatives Methoxybenzenes Anisoles Phenoxy compounds Bromobenzenes Alkyl aryl ethers Aryl bromides Tertiary carboxylic acid amides Pyrroles Amino acids Lactams Carboxylic acid salts Tertiary amines Carboxylic acids Azacyclic compounds Organobromides Carbonyl compounds Hydrocarbon derivatives Organic oxides Organic anions
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Acylaminobenzoic acid or derivatives - 1-phenylpyrroline - 2-phenylpyrroline - Benzoic acid - Phenoxy compound - Anisole - Benzoyl - Methoxybenzene - Phenol ether - Alkyl aryl ether - Halobenzene - Bromobenzene - Aryl bromide - Aryl halide - Pyrrole - Tertiary carboxylic acid amide - Pyrroline - Carboxylic acid salt - Amino acid - Carboxamide group - Lactam - Amino acid or derivatives - Tertiary amine - Organoheterocyclic compound - Azacycle - Carboxylic acid derivative - Ether - Carboxylic acid - Organic nitrogen compound - Amine - Organohalogen compound - Carbonyl group - Organobromide - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic anion - 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