Compound Identification
SMILES
CC1=CC=C(C=C1)S(=O)(=O)C(=C/C1=CC=CC=C1)\C(Cl)=O
InChIKey
InChIKey=WLHATWZQFPFCOS-PTNGSMBKSA-N
Formula
C16H13ClO3S
Mass
320.79
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
Tosyl compounds Benzenesulfonyl compounds Sulfones Acyl chlorides Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Cinnamic acid or derivatives - Tosyl compound - Benzenesulfonyl group - Toluene - Monocyclic benzene moiety - Benzenoid - Sulfonyl - Sulfone - Acyl chloride - Acyl halide - Organic oxygen compound - Organooxygen compound - Organochloride - Organohalogen compound - Organosulfur compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Aromatic homomonocyclic 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