N-(2-methylpropyl)-4-(piperidin-1-ium-4-ylmethyl)benzenesulfonamide

Systemtic Name: N-(2-methylpropyl)-4-(piperidin-1-ium-4-ylmethyl)benzenesulfonamide Openeye Name: N-isobutyl-4-(piperidin-1-ium-4-ylmethyl)benzenesulfonamide CAS Name: N-(2-methylpropyl)-4-(4-piperidin-1-iumylmethyl)benzenesulfonamide IUPAC Name: N-(2-methylpropyl)-4-(piperidin-1-ium-4-ylmethyl)benzenesulfonamide Traditional Name: N-isobutyl-4-(piperidin-1-ium-4-ylmethyl)benzenesulfonamide Formula: C16H27N2O2S+ MolecularWeight: 311.46278

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNS(=O)(=O)C1=CC=C(C=C1)CC2CC[NH2+]CC2

Isomeric SMILES

CC(C)CNS(=O)(=O)C1=CC=C(C=C1)CC2CC[NH2+]CC2

InChI

InChI=1S/C16H26N2O2S/c1-13(2)12-18-21(19,20)16-5-3-14(4-6-16)11-15-7-9-17-10-8-15/h3-6,13,15,17-18H,7-12H2,1-2H3/p+1