Compound Identification
SMILES
COC1=C(OCCOC2=CC=C(C=C2)C2=C(CNCC2)C(=O)N(CC2=C(Cl)C(Cl)=CC=C2)C2CC2)C=CC(Cl)=C1
InChIKey
InChIKey=MPZVIMKAJUUMSX-UHFFFAOYSA-N
Formula
C31H31Cl3N2O4
Mass
601.95
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
Phenoxy compounds Methoxybenzenes Dichlorobenzenes Anisoles Alkyl aryl ethers Hydropyridines Aryl chlorides Tertiary carboxylic acid amides Amino acids and derivatives Dialkylamines Azacyclic compounds Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Cinnamic acid or derivatives - Phenoxy compound - Anisole - 1,2-dichlorobenzene - Methoxybenzene - Phenol ether - Alkyl aryl ether - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Hydropyridine - Benzenoid - Tertiary carboxylic acid amide - Amino acid or derivatives - Carboxamide group - Secondary amine - Carboxylic acid derivative - Secondary aliphatic amine - Azacycle - Ether - Organoheterocyclic compound - Organochloride - Organic oxygen compound - Carbonyl group - Organohalogen compound - Amine - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen 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