Compound Identification
SMILES
OC(=O)N1CCCC1C(=O)\C=C\C1=CC=C(Cl)C=C1
InChIKey
InChIKey=LSNWXTFOZVMATF-VMPITWQZSA-N
Formula
C14H14ClNO3
Mass
279.72
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
Styrenes Pyrrolidine carboxylic acids Chlorobenzenes Aryl chlorides Enones Acryloyl compounds Tertiary amines Ketones Carbamic acids Azacyclic compounds Organochlorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Cinnamic acid or derivatives - Styrene - Pyrrolidine carboxylic acid or derivatives - Pyrrolidine carboxylic acid - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Acryloyl-group - Alpha,beta-unsaturated ketone - Enone - Pyrrolidine - Carbamic acid - Carbamic acid derivative - Tertiary amine - Ketone - Organoheterocyclic compound - Azacycle - Organooxygen compound - Carbonyl group - Amine - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organohalogen compound - Organochloride - Organonitrogen 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