Compound Identification
SMILES
CC(C)OC(=O)C1=C(Cl)C=CC(NC(=O)C2=C(OCCS2)C2=CC=CC=C2)=C1
InChIKey
InChIKey=HMDRGUWLBVRNON-UHFFFAOYSA-N
Formula
C21H20ClNO4S
Mass
417.9
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
Cinnamic acid amides 2-halobenzoic acids and derivatives Benzoic acid esters Anilides N-arylamides Benzoyl derivatives Chlorobenzenes Oxathiins Aryl chlorides Vinylogous halides Vinylogous esters Thioenol ethers Secondary carboxylic acid amides Carboxylic acid esters Oxacyclic compounds Hydrocarbon derivatives Organic oxides Organochlorides Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Acylaminobenzoic acid or derivatives - Cinnamic acid amide - Cinnamic acid or derivatives - Benzoate ester - Halobenzoic acid or derivatives - 2-halobenzoic acid or derivatives - Anilide - Benzoyl - N-arylamide - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - 1,4-oxathiin - Vinylogous ester - Vinylogous halide - Carboxamide group - Carboxylic acid ester - Thioenolether - Secondary carboxylic acid amide - Organoheterocyclic compound - Oxacycle - Carboxylic acid derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen 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