Compound Identification
SMILES
CC(=CC(=O)C=CC1=CC=CC=C1)C1=C(C)NC2=CC=CC=C12
InChIKey
InChIKey=YTBMDZFTXYXFIM-UHFFFAOYSA-N
Formula
C21H19NO
Mass
301.389
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
Indoles Styrenes Substituted pyrroles Heteroaromatic compounds Enones Acryloyl compounds Ketones Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cinnamic acid or derivatives - Indole - Indole or derivatives - Styrene - Monocyclic benzene moiety - Substituted pyrrole - Benzenoid - Acryloyl-group - Enone - Pyrrole - Heteroaromatic compound - Alpha,beta-unsaturated ketone - Ketone - Azacycle - Organoheterocyclic compound - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Carbonyl group - Organic oxygen compound - Aromatic heteropolycyclic 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