Compound Identification
SMILES
COC(=O)C1=C(C)NC(C(=O)\C=C\C2=CC(Cl)=CC=C2)=C1C
InChIKey
InChIKey=SSVIORHZXIQVDF-BQYQJAHWSA-N
Formula
C17H16ClNO3
Mass
317.77
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
Aryl ketones Pyrrole carboxylic acids and derivatives Styrenes Chlorobenzenes Aryl chlorides Substituted pyrroles Methyl esters Heteroaromatic compounds Enones Acryloyl compounds Vinylogous amides Azacyclic compounds Organonitrogen compounds Organochlorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Cinnamic acid or derivatives - Pyrrole-3-carboxylic acid or derivatives - Styrene - Aryl ketone - Chlorobenzene - Halobenzene - Aryl halide - Monocyclic benzene moiety - Substituted pyrrole - Benzenoid - Aryl chloride - Methyl ester - Vinylogous amide - Alpha,beta-unsaturated ketone - Pyrrole - Acryloyl-group - Heteroaromatic compound - Enone - Carboxylic acid ester - Ketone - Organoheterocyclic compound - Carboxylic acid derivative - Azacycle - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxygen compound - Organic oxide - Organochloride - Organohalogen 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