Compound Identification
SMILES
COC1=C(C)C=C(C(C#N)C(C)=O)C(C)=C1
InChIKey
InChIKey=VQRCPADFMZSKFC-UHFFFAOYSA-N
Formula
C13H15NO2
Mass
217.268
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Phenylpropanes
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Phenylpropanes
Intermediate Tree Nodes
Not available
Direct Parent
Phenylpropanes
Alternative Parents
p-Xylenes Phenoxy compounds Methoxybenzenes Anisoles Alkyl aryl ethers Ketones Nitriles Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Phenylpropane - Anisole - Phenol ether - Methoxybenzene - Xylene - P-xylene - Phenoxy compound - Alkyl aryl ether - Ketone - Nitrile - Carbonitrile - Ether - Hydrocarbon derivative - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Carbonyl group - Organic oxide - Cyanide - Organic oxygen compound - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenylpropanes. These are organic compounds containing a phenylpropane moiety.
External Descriptors
Not available