Compound Identification
SMILES
COC1=CC=CC(CCCC2=C(CC#N)C=CC(OC)=C2OC)=C1
InChIKey
InChIKey=XPQAOXIDRDAAOD-UHFFFAOYSA-N
Formula
C20H23NO3
Mass
325.408
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Linear 1,3-diarylpropanoids
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Linear 1,3-diarylpropanoids
Alternative Parents
Dimethoxybenzenes Benzyl cyanides Phenoxy compounds Anisoles Alkyl aryl ethers Nitriles Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Linear 1,3-diarylpropanoid - Dimethoxybenzene - O-dimethoxybenzene - Benzyl-cyanide - Anisole - Phenol ether - Phenoxy compound - Methoxybenzene - Alkyl aryl ether - Benzenoid - Monocyclic benzene moiety - Nitrile - Carbonitrile - Ether - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Organic oxygen compound - Cyanide - Hydrocarbon derivative - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as linear 1,3-diarylpropanoids. These are organic compounds with a structure based on a C6-C3-C6 skeleton, where the two benzene rings are not linked together.
External Descriptors
Not available