Compound Identification
SMILES
CC(C)(C)OC(=O)N[C@@H](CC1=CC=CC=C1)C(=O)C(\C#N)=C(\O)C1=CC=CC=C1
InChIKey
InChIKey=DSQSMBWMJWKPET-WOOAAIBNSA-N
Formula
C23H24N2O4
Mass
392.455
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
Amphetamines and derivatives Alpha-branched alpha,beta-unsaturated ketones Vinylogous acids Enones Carbamate esters Acryloyl compounds Ketones Nitriles Enols Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Cinnamic acid or derivatives - Amphetamine or derivatives - Monocyclic benzene moiety - Benzenoid - Alpha-branched alpha,beta-unsaturated-ketone - Vinylogous acid - Acryloyl-group - Alpha,beta-unsaturated ketone - Enone - Carbamic acid ester - Ketone - Enol - Carbonitrile - Nitrile - Organooxygen compound - Organic nitrogen compound - Cyanide - Organic oxygen compound - Carbonyl group - Organic oxide - Hydrocarbon derivative - Organonitrogen compound - Aromatic homomonocyclic 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