Compound Identification
SMILES
CC1=C(C=C2C=CC=NC2=N1)C(=O)\C=C\C1=CC(Cl)=CC(Cl)=C1O
InChIKey
InChIKey=OMADSIVYZQZSAQ-SNAWJCMRSA-N
Formula
C18H12Cl2N2O2
Mass
359.21
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Cinnamic acids and derivatives
Subclass
Hydroxycinnamic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Hydroxycinnamic acids and derivatives
Alternative Parents
Naphthyridines Styrenes P-chlorophenols Aryl ketones Dichlorobenzenes O-chlorophenols Methylpyridines Aryl chlorides Acryloyl compounds Heteroaromatic compounds Enones Azacyclic compounds Hydrocarbon derivatives Organochlorides Organonitrogen compounds Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Hydroxycinnamic acid or derivatives - Naphthyridine - 2-chlorophenol - 4-chlorophenol - Styrene - 1,3-dichlorobenzene - Aryl ketone - 4-halophenol - 2-halophenol - Methylpyridine - Phenol - Chlorobenzene - Halobenzene - Aryl halide - Pyridine - Monocyclic benzene moiety - Benzenoid - Aryl chloride - Acryloyl-group - Heteroaromatic compound - Enone - Alpha,beta-unsaturated ketone - Ketone - Organoheterocyclic compound - Azacycle - Organooxygen compound - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organochloride - Organohalogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as hydroxycinnamic acids and derivatives. These are compounds containing an cinnamic acid (or a derivative thereof) where the benzene ring is hydroxylated.
External Descriptors
Not available