Compound Identification
SMILES
OC(=O)C1=CC=CC=C1\C=C\C(=O)C1=CN=CC=C1
InChIKey
InChIKey=UMRQMQWMTRXKTP-BQYQJAHWSA-N
Formula
C15H11NO3
Mass
253.257
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
Benzoic acids Styrenes Benzoyl derivatives Aryl ketones Pyridines and derivatives Heteroaromatic compounds Enones Acryloyl compounds Carboxylic acids Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Cinnamic acid or derivatives - Benzoic acid or derivatives - Benzoic acid - Benzoyl - Aryl ketone - Styrene - Monocyclic benzene moiety - Benzenoid - Pyridine - Acryloyl-group - Heteroaromatic compound - Alpha,beta-unsaturated ketone - Enone - Ketone - Azacycle - Carboxylic acid derivative - Carboxylic acid - Organoheterocyclic compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxygen compound - Organic oxide - Organooxygen compound - 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