Compound Identification
SMILES
CC(=O)C(=C/C1=CC=CC2=NON=C12)\C(=O)OCCCl
InChIKey
InChIKey=PNSJIVFEUJAJBZ-JXMROGBWSA-N
Formula
C13H11ClN2O4
Mass
294.69
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
Class
Cinnamic acids and derivatives
- Subclass Cinnamic acid esters
-
Class
Cinnamic acids and derivatives
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Cinnamic acids and derivatives
Subclass
Cinnamic acid esters
Intermediate Tree Nodes
Not available
Direct Parent
Cinnamic acid esters
Alternative Parents
Benzoxadiazoles Beta-keto acids and derivatives Fatty acid esters Alpha-branched alpha,beta-unsaturated ketones Benzenoids Heteroaromatic compounds Furazans Enones Enoate esters Acryloyl compounds Ketones Oxacyclic compounds Azacyclic compounds Monocarboxylic acids and derivatives Hydrocarbon derivatives Organochlorides Organonitrogen compounds Alkyl chlorides Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cinnamic acid ester - Benzoxadiazole - Fatty acid ester - Beta-keto acid - Keto acid - Benzenoid - Alpha-branched alpha,beta-unsaturated-ketone - Fatty acyl - Azole - Furazan - Alpha,beta-unsaturated ketone - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Acryloyl-group - Oxadiazole - Enone - Heteroaromatic compound - Ketone - Carboxylic acid ester - Carboxylic acid derivative - Oxacycle - Azacycle - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Alkyl halide - Alkyl chloride - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organonitrogen compound - Organochloride - Organic oxygen compound - Organohalogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as cinnamic acid esters. These are compound containing an ester derivative of cinnamic acid.
External Descriptors
Not available