Compound Identification
SMILES
CC1=CC=C(C=C1)S(=O)N[C@](C)(C[N+]([O-])=O)C1=CC=CC=C1
InChIKey
InChIKey=FSQDTZIVZOBZKQ-XESZBRCGSA-N
Formula
C16H18N2O3S
Mass
318.39
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
Sulfinic acid amides C-nitro compounds Aminosulfinyl compounds Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Organonitrogen compounds Organic zwitterions Organic salts Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Toluene - C-nitro compound - Sulfinic acid amide - Sulfinic acid derivative - Aminosulfinyl compound - Organic nitro compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Sulfinyl compound - Organic oxoazanium - Organic zwitterion - Organonitrogen compound - Organic nitrogen compound - Organic salt - Organosulfur compound - Hydrocarbon derivative - Organic oxide - Organic oxygen 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