Compound Identification
SMILES
CN(CC1=NON=C1C)C(=O)[C@@H]1CC11CCN(CC1)C(=O)\C=C\C1=CC=CC=C1Cl
InChIKey
InChIKey=AKLNHCNBRLRPML-OZSKJFCKSA-N
Formula
C22H25ClN4O3
Mass
428.92
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
N-acylpiperidines Styrenes Chlorobenzenes Aryl chlorides Cyclopropanecarboxylic acids and derivatives Tertiary carboxylic acid amides Heteroaromatic compounds Furazans Tertiary amines Amino acids and derivatives Oxacyclic compounds Azacyclic compounds Carbonyl compounds Organochlorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cinnamic acid or derivatives - N-acyl-piperidine - Styrene - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Cyclopropanecarboxylic acid or derivatives - Benzenoid - Piperidine - Azole - Heteroaromatic compound - Tertiary carboxylic acid amide - Furazan - Oxadiazole - Amino acid or derivatives - Carboxamide group - Tertiary amine - Organoheterocyclic compound - Azacycle - Oxacycle - Carboxylic acid derivative - Organooxygen compound - Amine - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organonitrogen compound - Organohalogen compound - Organochloride - 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