Compound Identification
SMILES
OC1=C(C(N(C1=O)C1=CC=CC=C1)C1=CC(=CC=C1)[N+]([O-])=O)C(=O)\C=C\C1=CC=CC=C1
InChIKey
InChIKey=RQDPDDWHELXZBW-CCEZHUSRSA-N
Formula
C25H18N2O5
Mass
426.428
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
Phenylpyrrolines Nitrobenzenes Styrenes Nitroaromatic compounds Vinylogous acids Tertiary carboxylic acid amides Pyrroles Acryloyl compounds Enones Ketones Lactams Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Enols Organic oxoazanium compounds Hydrocarbon derivatives Organic zwitterions Organic salts Organonitrogen compounds Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Cinnamic acid or derivatives - 1-phenylpyrroline - 2-phenylpyrroline - Nitrobenzene - Nitroaromatic compound - Styrene - Monocyclic benzene moiety - Benzenoid - Acryloyl-group - Enone - Vinylogous acid - Pyrrole - Alpha,beta-unsaturated ketone - Pyrroline - Tertiary carboxylic acid amide - Carboxamide group - Ketone - Lactam - C-nitro compound - Organic nitro compound - Organoheterocyclic compound - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organic oxoazanium - Azacycle - Carboxylic acid derivative - Enol - Organic zwitterion - Hydrocarbon derivative - Organic oxygen compound - Organic oxide - Carbonyl group - Organic salt - Organonitrogen compound - Organooxygen compound - Organic nitrogen 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