4-tert-butyl-N-(2-cyclopentyl-5-methyl-1H-pyrazol-2-ium-3-yl)benzenesulfonamide

Systemtic Name: 4-tert-butyl-N-(2-cyclopentyl-5-methyl-1H-pyrazol-2-ium-3-yl)benzenesulfonamide Openeye Name: 4-tert-butyl-N-(2-cyclopentyl-5-methyl-1H-pyrazol-2-ium-3-yl)benzenesulfonamide CAS Name: 4-tert-butyl-N-(2-cyclopentyl-5-methyl-1H-pyrazol-2-ium-3-yl)benzenesulfonamide IUPAC Name: 4-tert-butyl-N-(2-cyclopentyl-5-methyl-1H-pyrazol-2-ium-3-yl)benzenesulfonamide Traditional Name: 4-tert-butyl-N-(2-cyclopentyl-5-methyl-1H-pyrazol-2-ium-3-yl)benzenesulfonamide Formula: C19H28N3O2S+ MolecularWeight: 362.50952

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[N+](N1)C2CCCC2)NS(=O)(=O)C3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CC1=CC(=[N+](N1)C2CCCC2)NS(=O)(=O)C3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C19H27N3O2S/c1-14-13-18(22(20-14)16-7-5-6-8-16)21-25(23,24)17-11-9-15(10-12-17)19(2,3)4/h9-13,16H,5-8H2,1-4H3,(H,20,21)/p+1