Compound Identification
SMILES
O=C(C1=C(C(C(=O)C2=CC=CC=C2)=[N+]2C=CC3=CC=CC=C3C12)C1=CC=CC=C1)C1=CC=CC=C1
InChIKey
InChIKey=RRGPVAHHOQGBBW-UHFFFAOYSA-N
Formula
C32H22NO2
Mass
452.532
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
Benzoyl derivatives Aryl ketones Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cinnamic acid or derivatives - Benzoyl - Aryl ketone - Monocyclic benzene moiety - Benzenoid - Ketone - Azacycle - Organoheterocyclic compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organic cation - 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