Compound Identification
SMILES
COC1=C(O)C(C=C(C#N)C(=O)NC2=CC=CC=C2C)=CC(I)=C1
InChIKey
InChIKey=MGHIIZCZDDRSPH-UHFFFAOYSA-N
Formula
C18H15IN2O3
Mass
434.233
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 Phenoxy compounds P-iodophenols Anisoles N-arylamides Methoxybenzenes Toluenes Alkyl aryl ethers Iodobenzenes Aryl iodides Secondary carboxylic acid amides Nitriles Carbonyl compounds Hydrocarbon derivatives Organic oxides Organoiodides Organopnictogen compounds
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Cinnamic acid amide - Hydroxycinnamic acid or derivatives - Methoxyphenol - Anilide - Anisole - 4-halophenol - Phenoxy compound - 4-iodophenol - Phenol ether - N-arylamide - Methoxybenzene - Phenol - Toluene - Iodobenzene - Alkyl aryl ether - Halobenzene - Aryl iodide - Aryl halide - Benzenoid - Monocyclic benzene moiety - Secondary carboxylic acid amide - Carboxamide group - Nitrile - Carbonitrile - Carboxylic acid derivative - Ether - Organic oxide - Organic nitrogen compound - Organic oxygen compound - Organohalogen compound - Organoiodide - Organonitrogen compound - Organooxygen compound - Organopnictogen compound - Carbonyl group - Hydrocarbon derivative - 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