Compound Identification
SMILES
CC1=CC=C(C=C1)S(=O)(=O)N1CCC[N+]([O-])(CC2=CC=CC=C2)CCCN(CC(=C)C1)S(=O)(=O)C1=CC=C(C)C=C1
InChIKey
InChIKey=CVMGMZVELDNFHW-UHFFFAOYSA-N
Formula
C31H39N3O5S2
Mass
597.79
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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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
Benzenesulfonamides Benzenesulfonyl compounds Organosulfonamides Trialkyl amine oxides Sulfonyls Trisubstituted amine oxides and derivatives Azacyclic compounds Organopnictogen compounds Organic zwitterions Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
N,n-disubstituted p-toluenesulfonamide - Benzenesulfonamide - Benzenesulfonyl group - Organosulfonic acid amide - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Sulfonyl - Trialkyl amine oxide - Azacycle - Organoheterocyclic compound - Trisubstituted n-oxide - N-oxide - Organic zwitterion - Organic nitrogen compound - Organic oxygen compound - Organosulfur compound - Hydrocarbon derivative - Organonitrogen compound - Organopnictogen compound - Organic oxide - 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