Compound Identification
SMILES
CC1=CC=CC=C1S(=O)(=O)CC1=CC=C(O1)C(=O)N1CC[NH+](CC1)C1CCCCC1
InChIKey
InChIKey=JEBVPCDMZSKJRC-UHFFFAOYSA-O
Formula
C23H31N2O4S
Mass
431.57
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Benzenesulfonyl compounds
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Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzenesulfonyl compounds
Intermediate Tree Nodes
Not available
Direct Parent
Benzenesulfonyl compounds
Alternative Parents
2-heteroaryl carboxamides Furoic acid and derivatives Toluenes Cyclohexylamines N-alkylpiperazines Tertiary carboxylic acid amides Sulfones Heteroaromatic compounds Quaternary ammonium salts Trialkylamines Amino acids and derivatives Azacyclic compounds Oxacyclic compounds Hydrocarbon derivatives Organic oxides Organooxygen compounds Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Benzenesulfonyl group - 2-heteroaryl carboxamide - Furoic acid or derivatives - Cyclohexylamine - Toluene - N-alkylpiperazine - 1,4-diazinane - Piperazine - Furan - Quaternary ammonium salt - Sulfone - Sulfonyl - Tertiary carboxylic acid amide - Heteroaromatic compound - Tertiary amine - Carboxamide group - Amino acid or derivatives - Tertiary aliphatic amine - Oxacycle - Carboxylic acid derivative - Azacycle - Organoheterocyclic compound - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organonitrogen compound - Amine - Organic oxygen compound - Organosulfur compound - Organic nitrogen compound - Organic cation - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as benzenesulfonyl compounds. These are aromatic compounds containing a benzenesulfonyl group, which consists of a monocyclic benzene moiety that carries a sulfonyl group.
External Descriptors
Not available