Compound Identification
SMILES
OC(=O)C1=C(SC2=C(Cl)C=C(Cl)C=C2)C=CC(\C=C\C(=O)N2CCOCC2)=C1
InChIKey
InChIKey=OWSMSBRRRUBQDJ-QHHAFSJGSA-N
Formula
C20H17Cl2NO4S
Mass
438.32
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 O-sulfanylbenzoic acids Benzoic acids Thiophenol ethers Styrenes Benzoyl derivatives Dichlorobenzenes Vinylogous thioesters Aryl chlorides Morpholines Tertiary carboxylic acid amides Sulfenyl compounds Azacyclic compounds Oxacyclic compounds Carboxylic acids Dialkyl ethers Monocarboxylic acids and derivatives Carbonyl compounds Organonitrogen compounds Organochlorides Hydrocarbon derivatives Organopnictogen compounds Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Cinnamic acid or derivatives - Diarylthioether - O-sulfanylbenzoic acid - O-sulfanylbenzoic acid or derivatives - Benzoic acid or derivatives - Benzoic acid - Aryl thioether - Benzoyl - 1,3-dichlorobenzene - Styrene - Thiophenol ether - Chlorobenzene - Halobenzene - Aryl chloride - Morpholine - Monocyclic benzene moiety - Aryl halide - Benzenoid - Oxazinane - Vinylogous thioester - Tertiary carboxylic acid amide - Carboxamide group - Ether - Carboxylic acid derivative - Dialkyl ether - Monocarboxylic acid or derivatives - Sulfenyl compound - Carboxylic acid - Oxacycle - Azacycle - Thioether - Organoheterocyclic compound - Organosulfur compound - Organic oxide - Hydrocarbon derivative - Organohalogen compound - Carbonyl group - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Organochloride - Organonitrogen compound - Organooxygen 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