Compound Identification
SMILES
COC1=CC=C(C=CC(=O)C2=CC=C(Cl)S2)C=C1
InChIKey
InChIKey=OCHRGIXGUNICDQ-UHFFFAOYSA-N
Formula
C14H11ClO2S
Mass
278.75
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
Styrenes Phenoxy compounds Methoxybenzenes Aryl ketones Anisoles Alkyl aryl ethers 2,5-disubstituted thiophenes Aryl chlorides Heteroaromatic compounds Enones Acryloyl compounds Organochlorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Cinnamic acid or derivatives - Anisole - Phenoxy compound - Phenol ether - Styrene - Aryl ketone - Methoxybenzene - 2,5-disubstituted thiophene - Alkyl aryl ether - Aryl chloride - Benzenoid - Aryl halide - Monocyclic benzene moiety - Alpha,beta-unsaturated ketone - Thiophene - Heteroaromatic compound - Acryloyl-group - Enone - Ketone - Organoheterocyclic compound - Ether - Organochloride - Organic oxygen compound - Organooxygen compound - Hydrocarbon derivative - Organohalogen compound - Organic oxide - 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