N-(3,3-dimethyl-2-oxidanylidene-butyl)-4-pyrrolidin-1-ylsulfonyl-benzenesulfonamide

Systemtic Name: N-(3,3-dimethyl-2-oxidanylidene-butyl)-4-pyrrolidin-1-ylsulfonyl-benzenesulfonamide Openeye Name: N-(3,3-dimethyl-2-oxo-butyl)-4-pyrrolidin-1-ylsulfonyl-benzenesulfonamide CAS Name: N-(3,3-dimethyl-2-oxobutyl)-4-(1-pyrrolidinylsulfonyl)benzenesulfonamide IUPAC Name: N-(3,3-dimethyl-2-oxobutyl)-4-pyrrolidin-1-ylsulfonylbenzenesulfonamide Traditional Name: N-(2-keto-3,3-dimethyl-butyl)-4-pyrrolidinosulfonyl-benzenesulfonamide Formula: C16H24N2O5S2 MolecularWeight: 388.50216

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)CNS(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCCC2

Isomeric SMILES

CC(C)(C)C(=O)CNS(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCCC2

InChI

InChI=1S/C16H24N2O5S2/c1-16(2,3)15(19)12-17-24(20,21)13-6-8-14(9-7-13)25(22,23)18-10-4-5-11-18/h6-9,17H,4-5,10-12H2,1-3H3