Compound Identification
SMILES
COC1=C(O)C(Br)=CC(C=C(C#N)C(=O)NC2=C(OC)C=C(Cl)C(C)=C2)=C1
InChIKey
InChIKey=ISWIZIFLGNTNNU-UHFFFAOYSA-N
Formula
C19H16BrClN2O4
Mass
451.7
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
Cinnamic acid amides Methoxyphenols Anilides Methoxyanilines Anisoles Phenoxy compounds Methoxybenzenes O-bromophenols N-arylamides Alkyl aryl ethers Toluenes Bromobenzenes Chlorobenzenes Aryl bromides Aryl chlorides Secondary carboxylic acid amides Nitriles Organochlorides Carbonyl compounds Hydrocarbon derivatives Organobromides Organic oxides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Cinnamic acid amide - Hydroxycinnamic acid or derivatives - Methoxyphenol - Anilide - Methoxyaniline - Anisole - 2-halophenol - Phenoxy compound - 2-bromophenol - Phenol ether - N-arylamide - Methoxybenzene - Toluene - Bromobenzene - Chlorobenzene - Halobenzene - Alkyl aryl ether - Phenol - Aryl halide - Aryl bromide - Aryl chloride - Monocyclic benzene moiety - Benzenoid - Secondary carboxylic acid amide - Carboxamide group - Nitrile - Carbonitrile - Ether - Carboxylic acid derivative - Organobromide - Organic oxide - Organic nitrogen compound - Cyanide - Carbonyl group - Hydrocarbon derivative - Organochloride - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Organohalogen compound - Aromatic homomonocyclic 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