Compound Identification
SMILES
CC1=CC=C(C=C1)[C@@H](Cl)[C@](O)(C#N)C(N)=O
InChIKey
InChIKey=UQDJQWJRPXKVGZ-MWLCHTKSSA-N
Formula
C11H11ClN2O2
Mass
238.67
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Toluenes
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Toluenes
Intermediate Tree Nodes
Not available
Direct Parent
Toluenes
Alternative Parents
Fatty amides Tertiary alcohols Primary carboxylic acid amides Cyanohydrins Chlorohydrins Alpha-hydroxynitriles Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds Alkyl chlorides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Toluene - Fatty amide - Fatty acyl - Tertiary alcohol - Carboxamide group - Chlorohydrin - Cyanohydrin - Alpha-hydroxynitrile - Halohydrin - Primary carboxylic acid amide - Carboxylic acid derivative - Carbonitrile - Nitrile - Organohalogen compound - Alkyl halide - Alkyl chloride - Hydrocarbon derivative - Organic oxide - Cyanide - Organic oxygen compound - Alcohol - Organic nitrogen compound - Carbonyl group - Organochloride - Organonitrogen compound - Organooxygen compound - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as toluenes. These are compounds containing a benzene ring which bears a methane group.
External Descriptors
Not available