Compound Identification
SMILES
COC1=C(OC)C=C(CCN(CC2=CC=C(C)O2)C(=O)CN(CCN2CCCC2)S(=O)(=O)C2=CC=C(C)C=C2)C=C1
InChIKey
InChIKey=WAIPLWFHKNKJQE-UHFFFAOYSA-N
Formula
C31H41N3O6S
Mass
583.74
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
Alpha amino acids and derivatives Dimethoxybenzenes Benzenesulfonamides Benzenesulfonyl compounds Phenoxy compounds Anisoles Alkyl aryl ethers Organosulfonamides N-alkylpyrrolidines Tertiary carboxylic acid amides Aminosulfonyl compounds Heteroaromatic compounds Furans Trialkylamines Oxacyclic compounds Azacyclic compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
N,n-disubstituted p-toluenesulfonamide - Dimethoxybenzene - O-dimethoxybenzene - Alpha-amino acid or derivatives - Benzenesulfonamide - Benzenesulfonyl group - Phenol ether - Phenoxy compound - Methoxybenzene - Anisole - Alkyl aryl ether - N-alkylpyrrolidine - Organosulfonic acid amide - Organic sulfonic acid or derivatives - Pyrrolidine - Furan - Aminosulfonyl compound - Tertiary carboxylic acid amide - Sulfonyl - Heteroaromatic compound - Organosulfonic acid or derivatives - Tertiary aliphatic amine - Tertiary amine - Carboxamide group - Amino acid or derivatives - Oxacycle - Azacycle - Carboxylic acid derivative - Ether - Organoheterocyclic compound - Amine - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Organic oxide - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Organosulfur compound - 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