Compound Identification
SMILES
ClC1=CC=CC=C1\C=C\C(=O)NNC(=O)CCN1CCN(CC2=CC=CC=C2)CC1
InChIKey
InChIKey=CBPWWLMFLURZFQ-ZHACJKMWSA-N
Formula
C23H27ClN4O2
Mass
426.95
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
Beta amino acids and derivatives Styrenes Phenylmethylamines Benzylamines N-alkylpiperazines Chlorobenzenes Aralkylamines Diacylhydrazines Aryl chlorides Trialkylamines Azacyclic compounds Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Cinnamic acid or derivatives - Beta amino acid or derivatives - Styrene - Phenylmethylamine - Benzylamine - Chlorobenzene - Aralkylamine - N-alkylpiperazine - Halobenzene - Diacylhydrazine - Aryl chloride - Aryl halide - Monocyclic benzene moiety - 1,4-diazinane - Benzenoid - Piperazine - Amino acid or derivatives - Tertiary aliphatic amine - Carboxylic acid hydrazide - Tertiary amine - Organoheterocyclic compound - Carboxylic acid derivative - Azacycle - Amine - Organohalogen compound - Organochloride - Carbonyl group - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen 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