Compound Identification
SMILES
O=C(NN1CC(=O)NC1=O)\C=C\C1=CC=C(C=C1)C#N
InChIKey
InChIKey=GUCDCGQBQZNQBQ-AATRIKPKSA-N
Formula
C13H10N4O3
Mass
270.248
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
Hydantoins Alpha amino acids and derivatives Styrenes Benzonitriles Semicarbazides Dicarboximides Organic carbonic acids and derivatives Carboxylic acid hydrazides Nitriles Azacyclic compounds Organopnictogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Cinnamic acid or derivatives - Hydantoin - Alpha-amino acid or derivatives - Benzonitrile - Styrene - Monocyclic benzene moiety - Benzenoid - Imidazolidinone - Dicarboximide - Imidazolidine - Semicarbazide - Carboxylic acid hydrazide - Carbonic acid derivative - Nitrile - Carbonitrile - Organoheterocyclic compound - Azacycle - Carboxylic acid derivative - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Carbonyl group - Organopnictogen compound - Organic oxygen 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