Compound Identification
SMILES
OC(=O)COC1=C(Cl)C(Cl)=C(C=CC(=O)C2=CC=CS2)C=C1
InChIKey
InChIKey=NEFNTKXPJAWGGJ-UHFFFAOYSA-N
Formula
C15H10Cl2O4S
Mass
357.2
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
Phenoxyacetic acid derivatives Styrenes Phenoxy compounds Phenol ethers Aryl ketones Dichlorobenzenes Alkyl aryl ethers Aryl chlorides Thiophenes Acryloyl compounds Heteroaromatic compounds Enones Monocarboxylic acids and derivatives Carboxylic acids Organochlorides Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Cinnamic acid or derivatives - Phenoxyacetate - Phenoxy compound - 1,2-dichlorobenzene - Aryl ketone - Styrene - Phenol ether - Halobenzene - Alkyl aryl ether - Chlorobenzene - Aryl chloride - Aryl halide - Benzenoid - Monocyclic benzene moiety - Enone - Thiophene - Alpha,beta-unsaturated ketone - Heteroaromatic compound - Acryloyl-group - Ketone - Organoheterocyclic compound - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Ether - Organic oxide - Carbonyl group - Organooxygen compound - Organochloride - Organohalogen compound - Hydrocarbon derivative - Organic oxygen 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