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

Systemtic Name: 4-bromanyl-N-(2-cyclopentyl-5-methyl-1H-pyrazol-2-ium-3-yl)benzenesulfonamide Openeye Name: 4-bromo-N-(2-cyclopentyl-5-methyl-1H-pyrazol-2-ium-3-yl)benzenesulfonamide CAS Name: 4-bromo-N-(2-cyclopentyl-5-methyl-1H-pyrazol-2-ium-3-yl)benzenesulfonamide IUPAC Name: 4-bromo-N-(2-cyclopentyl-5-methyl-1H-pyrazol-2-ium-3-yl)benzenesulfonamide Traditional Name: 4-bromo-N-(2-cyclopentyl-5-methyl-1H-pyrazol-2-ium-3-yl)benzenesulfonamide Formula: C15H19BrN3O2S+ MolecularWeight: 385.29926

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H18BrN3O2S/c1-11-10-15(19(17-11)13-4-2-3-5-13)18-22(20,21)14-8-6-12(16)7-9-14/h6-10,13H,2-5H2,1H3,(H,17,18)/p+1