Compound Identification
SMILES
CC1=C(C)C(=CC(=C1)C([O-])=O)S(=O)(=O)NCCNC1=CC=CC=[NH+]1
InChIKey
InChIKey=PLRLLWKDSAVRLA-UHFFFAOYSA-N
Formula
C16H19N3O4S
Mass
349.41
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Benzenesulfonamides
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Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzenesulfonamides
Intermediate Tree Nodes
Not available
Direct Parent
Benzenesulfonamides
Alternative Parents
Benzenesulfonyl compounds Benzoic acids o-Xylenes Benzoyl derivatives Secondary alkylarylamines Aminopyridines and derivatives Pyridinium derivatives Organosulfonamides Aminosulfonyl compounds Heteroaromatic compounds Carboxylic acid salts Amino acids Carboxylic acids Azacyclic compounds Organic oxides Organic salts Organic zwitterions Organooxygen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Benzenesulfonamide - Benzoic acid or derivatives - Benzenesulfonyl group - Benzoic acid - O-xylene - Xylene - Benzoyl - Aminopyridine - Secondary aliphatic/aromatic amine - Pyridine - Pyridinium - Organosulfonic acid amide - Heteroaromatic compound - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Sulfonyl - Aminosulfonyl compound - Amino acid or derivatives - Amino acid - Carboxylic acid salt - Secondary amine - Organoheterocyclic compound - Azacycle - Carboxylic acid derivative - Carboxylic acid - Organic zwitterion - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Amine - Organic oxide - Organic nitrogen compound - Organic salt - Organic oxygen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as benzenesulfonamides. These are organic compounds containing a sulfonamide group that is S-linked to a benzene ring.
External Descriptors
Not available