Compound Identification
SMILES
CC1=CC=C(C=C1)S(=O)(=O)OC[C@@]12CC[C@H]3CN([C@@H]([C@@H](N1S(=O)(=O)C1=CC=C(C)C=C1)C1=CC=CC=C1)[C@@H]23)S(=O)(=O)C1=CC=C(C)C=C1
InChIKey
InChIKey=RFIQJNLMKBPWSM-NVCDYGDZSA-N
Formula
C36H38N2O7S3
Mass
706.89
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
p-Methylbenzenesulfonates Benzenesulfonate esters Phenylpyrrolidines Benzenesulfonamides Arylsulfonic acids and derivatives Benzenesulfonyl compounds Organosulfonamides Organosulfonic acid esters Pyrroles Sulfonyls Azacyclic compounds Organopnictogen compounds Organooxygen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N,n-disubstituted p-toluenesulfonamide - 2-phenylpyrrolidine - P-methylbenzenesulfonate - Benzenesulfonate ester - Benzenesulfonamide - Benzenesulfonate - Arylsulfonic acid or derivatives - Benzenesulfonyl group - Organosulfonic acid amide - Organosulfonic acid ester - Pyrrole - Pyrrolidine - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Sulfonyl - Azacycle - Organoheterocyclic compound - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxygen compound - Organosulfur compound - Organooxygen compound - Organopnictogen compound - Organic oxide - Aromatic heteropolycyclic 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