Compound Identification
SMILES
COC1=C(OCCOC2=CC=C(C=C2)C2=C(CNCC2)C(=O)N(CC2=CC=CC(C)=C2C)C2CC2)C=CC(Cl)=C1
InChIKey
InChIKey=OZEMDWYPAFICGO-UHFFFAOYSA-N
Formula
C33H37ClN2O4
Mass
561.12
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
o-Xylenes Phenoxy compounds Methoxybenzenes Anisoles Alkyl aryl ethers Chlorobenzenes Hydropyridines Aryl chlorides Tertiary carboxylic acid amides Amino acids and derivatives Dialkylamines Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organochlorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Cinnamic acid or derivatives - Phenoxy compound - Anisole - O-xylene - Xylene - Methoxybenzene - Phenol ether - Alkyl aryl ether - Chlorobenzene - Halobenzene - Aryl chloride - Benzenoid - Hydropyridine - Monocyclic benzene moiety - Aryl halide - Tertiary carboxylic acid amide - Carboxamide group - Amino acid or derivatives - Carboxylic acid derivative - Organoheterocyclic compound - Ether - Secondary aliphatic amine - Azacycle - Secondary amine - Organic nitrogen compound - Organohalogen compound - Organochloride - Carbonyl group - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Amine - 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