Compound Identification
SMILES
CC1=CC=C(C=C1)S(=O)(=O)N1CCN(CC1)C1=C(C=C(C=O)C=C1)[N+]([O-])=O
InChIKey
InChIKey=TVIHTQUCOKBVRO-UHFFFAOYSA-N
Formula
C18H19N3O5S
Mass
389.43
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Benzenoids
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Class
Benzene and substituted derivatives
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Subclass
Toluenes
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Level 5
Tosyl compounds
- Level 6 P-toluenesulfonamides
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Level 5
Tosyl compounds
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Subclass
Toluenes
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Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Toluenes
Intermediate Tree Nodes
Tosyl compounds - P-toluenesulfonamides
Direct Parent
N,N-disubstituted p-toluenesulfonamides
Alternative Parents
Phenylpiperazines N-arylpiperazines Nitrobenzaldehydes Benzenesulfonamides Benzenesulfonyl compounds Aniline and substituted anilines Benzaldehydes Benzoyl derivatives Dialkylarylamines Nitroaromatic compounds Organosulfonamides Sulfonyls Azacyclic compounds Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Hydrocarbon derivatives Organic salts Organic oxides Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
N,n-disubstituted p-toluenesulfonamide - N-arylpiperazine - Phenylpiperazine - Nitrobenzaldehyde - Benzenesulfonamide - Benzenesulfonyl group - Nitrobenzene - Benzaldehyde - Benzoyl - Aniline or substituted anilines - Dialkylarylamine - Nitroaromatic compound - Tertiary aliphatic/aromatic amine - Aryl-aldehyde - 1,4-diazinane - Piperazine - Organosulfonic acid amide - Sulfonyl - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - C-nitro compound - Organic nitro compound - Tertiary amine - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Allyl-type 1,3-dipolar organic compound - Organoheterocyclic compound - Azacycle - Organic oxoazanium - Organic salt - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Organosulfur compound - Amine - Aldehyde - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic cation - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as n,n-disubstituted p-toluenesulfonamides. These are p-toluenesulfonamide derivatives in which the sulfonamide moiety is N,N-disubstituted.
External Descriptors
Not available