Compound Identification
SMILES
CC(C)C1=CC=CC=C1SC1=C(Cl)C(Cl)=C(\C=C\C(=O)N2CCC(CC2)C(O)=O)C=C1
InChIKey
InChIKey=SYGPJZDISKKEIV-CSKARUKUSA-N
Formula
C24H25Cl2NO3S
Mass
478.43
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Cinnamic acids and derivatives
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Cinnamic acids and derivatives
Alternative Parents
Diarylthioethers Cumenes N-acylpiperidines Phenylpropanes Piperidinecarboxylic acids Dichlorobenzenes Thiophenol ethers Styrenes Aryl chlorides Tertiary carboxylic acid amides Azacyclic compounds Monocarboxylic acids and derivatives Carboxylic acids Sulfenyl compounds Carbonyl compounds Organonitrogen compounds Organochlorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Cinnamic acid or derivatives - Diarylthioether - N-acyl-piperidine - Phenylpropane - Piperidinecarboxylic acid - Cumene - Aryl thioether - Styrene - 1,2-dichlorobenzene - Thiophenol ether - Halobenzene - Chlorobenzene - Piperidine - Monocyclic benzene moiety - Aryl halide - Aryl chloride - Benzenoid - Tertiary carboxylic acid amide - Carboxamide group - Carboxylic acid derivative - Carboxylic acid - Azacycle - Organoheterocyclic compound - Sulfenyl compound - Thioether - Monocarboxylic acid or derivatives - Carbonyl group - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as cinnamic acids and derivatives. These are organic aromatic compounds containing a benzene and a carboxylic acid group (or a derivative thereof) forming 3-phenylprop-2-enoic acid.
External Descriptors
Not available