Compound Identification
SMILES
COC(=O)C1=C(Cl)C=CC(=C1)N1[C@@H](S[C@H](CC(=O)NCCC2=CC(OC)=C(OC)C=C2)C1=O)C1=CC=C(OCC2=CC=CC=C2)C=C1
InChIKey
InChIKey=WPBCRHVKUMQMAH-LDNVYYCDSA-N
Formula
C36H35ClN2O7S
Mass
675.19
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
Benzoic acid esters Dimethoxybenzenes 2-halobenzoic acids and derivatives Benzoyl derivatives Phenoxy compounds Anisoles Chlorobenzenes Alkyl aryl ethers Aryl chlorides Vinylogous halides Thiazolidines Tertiary carboxylic acid amides Methyl esters Secondary carboxylic acid amides Lactams Dialkylthioethers Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organochlorides Organonitrogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Acylaminobenzoic acid or derivatives - 2-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Dimethoxybenzene - O-dimethoxybenzene - Benzoate ester - Phenol ether - Methoxybenzene - Benzoyl - Anisole - Phenoxy compound - Halobenzene - Chlorobenzene - Alkyl aryl ether - Aryl halide - Aryl chloride - Thiazolidine - Vinylogous halide - Methyl ester - Tertiary carboxylic acid amide - Carboxamide group - Carboxylic acid ester - Lactam - Secondary carboxylic acid amide - Thioether - Ether - Dialkylthioether - Carboxylic acid derivative - Organoheterocyclic compound - Azacycle - Organohalogen compound - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organochloride - Organonitrogen compound - Organooxygen compound - Organic oxide - 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