Compound Identification
SMILES
CCCOC1=C(OC)C=C(\C=C\C(=O)C2=CC=C(S2)C([O-])=O)C=C1Cl
InChIKey
InChIKey=DNCYMYLLQJIOBH-SNAWJCMRSA-M
Formula
C18H16ClO5S
Mass
379.83
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
Thiophene carboxylic acids Styrenes Phenoxy compounds Anisoles Methoxybenzenes Aryl ketones 2,5-disubstituted thiophenes Alkyl aryl ethers Chlorobenzenes Aryl chlorides Acryloyl compounds Heteroaromatic compounds Enones Carboxylic acid salts Carboxylic acids Organochlorides Hydrocarbon derivatives Organic oxides Organic anions
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Cinnamic acid or derivatives - Phenoxy compound - Phenol ether - Anisole - Styrene - Methoxybenzene - Thiophene carboxylic acid - Thiophene carboxylic acid or derivatives - Aryl ketone - Halobenzene - Chlorobenzene - Alkyl aryl ether - 2,5-disubstituted thiophene - Aryl chloride - Monocyclic benzene moiety - Aryl halide - Benzenoid - Alpha,beta-unsaturated ketone - Heteroaromatic compound - Enone - Acryloyl-group - Thiophene - Carboxylic acid salt - Ketone - Organoheterocyclic compound - Carboxylic acid derivative - Carboxylic acid - Ether - Organic oxide - Organooxygen compound - Organic oxygen compound - Organochloride - Hydrocarbon derivative - Organohalogen compound - Organic anion - 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