Compound Identification
SMILES
CC1=CC=C(C=C1)S(=O)(=O)C1=CC=CC(N)=C1C#N
InChIKey
InChIKey=RDGYQSLTDBICQU-UHFFFAOYSA-N
Formula
C14H12N2O2S
Mass
272.32
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Toluenes
- Level 5 Tosyl compounds
-
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
Tosyl compounds
Alternative Parents
Benzenesulfonyl compounds Benzonitriles Aniline and substituted anilines Sulfones Nitriles Primary amines Organopnictogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Tosyl compound - Benzenesulfonyl group - Benzonitrile - Aniline or substituted anilines - Sulfone - Sulfonyl - Nitrile - Carbonitrile - Organopnictogen compound - Organic oxygen compound - Amine - Primary amine - Organosulfur compound - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as tosyl compounds. These are organosulfur compounds containing a tosyl group, with the general formula CH3C6H4S(O2)R (R = any atom).
External Descriptors
Not available