Compound Identification
SMILES
COC1=CC(OC)=C(C=C1)[C@H]1N(C(=O)C(O)=C1C(C)=O)C1=CC=C(C=C1)C(O)=O
InChIKey
InChIKey=XOQUMJXCABZEBS-GOSISDBHSA-N
Formula
C21H19NO7
Mass
397.383
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 Dimethoxybenzenes Benzoic acids Anisoles Benzoyl derivatives Phenoxy compounds Alkyl aryl ethers Tertiary carboxylic acid amides Vinylogous acids Pyrroles Lactams Ketones Enols Carboxylic acids Azacyclic compounds Organic oxides Hydrocarbon derivatives Organonitrogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Acylaminobenzoic acid or derivatives - 1-phenylpyrroline - 2-phenylpyrroline - Dimethoxybenzene - M-dimethoxybenzene - Benzoic acid - Benzoyl - Methoxybenzene - Anisole - Phenoxy compound - Phenol ether - Alkyl aryl ether - Vinylogous acid - Tertiary carboxylic acid amide - Pyrroline - Pyrrole - Carboxamide group - Ketone - Lactam - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Carboxylic acid - Enol - Ether - Organic oxide - Hydrocarbon derivative - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - 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