Compound Identification
SMILES
CC1=C(OCC2=NC3=C(C=CC(Cl)=C3)C=C2)C(C\C=C\C2=CC=CC=C2\C=C\C(O)=O)=CC=C1
InChIKey
InChIKey=NPDYLBIJLLJVLW-DRCXFWSUSA-N
Formula
C29H24ClNO3
Mass
469.97
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
Cinnamic acids Chloroquinolines Styrenes Phenoxy compounds Phenol ethers Toluenes Alkyl aryl ethers Pyridines and derivatives Aryl chlorides Heteroaromatic compounds Azacyclic compounds Carboxylic acids Monocarboxylic acids and derivatives Organochlorides Carbonyl compounds Organic oxides Organonitrogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Linear 1,3-diarylpropanoid - Cinnamic acid - Cinnamic acid or derivatives - Chloroquinoline - Haloquinoline - Quinoline - Phenoxy compound - Styrene - Phenol ether - Alkyl aryl ether - Toluene - Aryl chloride - Monocyclic benzene moiety - Benzenoid - Aryl halide - Pyridine - Heteroaromatic compound - Organoheterocyclic compound - Carboxylic acid derivative - Carboxylic acid - Azacycle - Monocarboxylic acid or derivatives - Ether - Organic oxide - Organohalogen compound - Organic nitrogen compound - Organochloride - Organonitrogen compound - Carbonyl group - Organooxygen compound - Organic oxygen compound - Hydrocarbon derivative - Aromatic heteropolycyclic 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