Compound Identification
SMILES
CC(O)CN1C(C)=NC(CS(=O)(=O)C2=CC=C(C)C=C2)=C1[N+]([O-])=O
InChIKey
InChIKey=ITNHMPSDBJWOHG-UHFFFAOYSA-N
Formula
C15H19N3O5S
Mass
353.39
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Toluenes
- Level 5 Tosyl compounds
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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
1,2,4,5-tetrasubstituted imidazoles Benzenesulfonyl compounds Nitroimidazoles Nitroaromatic compounds N-substituted imidazoles Sulfones Heteroaromatic compounds Secondary alcohols Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic oxoazanium compounds Hydrocarbon derivatives Organic oxides Organic salts Organic zwitterions Organonitrogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Tosyl compound - 1,2,4,5-tetrasubstituted imidazole - Benzenesulfonyl group - Nitroimidazole - Nitroaromatic compound - N-substituted imidazole - Azole - Heteroaromatic compound - Imidazole - Sulfone - Sulfonyl - Organic nitro compound - C-nitro compound - Secondary alcohol - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Azacycle - Organic oxoazanium - Organoheterocyclic compound - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic nitrogen compound - Organic oxygen compound - Organosulfur compound - Organic oxide - Organic salt - Alcohol - Organic zwitterion - Aromatic heteromonocyclic 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