1-(4-methylphenyl)-N-[(1-propan-2-ylpiperidin-1-ium-4-yl)methyl]methanesulfonamide

Systemtic Name: 1-(4-methylphenyl)-N-[(1-propan-2-ylpiperidin-1-ium-4-yl)methyl]methanesulfonamide Openeye Name: N-[(1-isopropylpiperidin-1-ium-4-yl)methyl]-1-(p-tolyl)methanesulfonamide CAS Name: 1-(4-methylphenyl)-N-[(1-propan-2-yl-4-piperidin-1-iumyl)methyl]methanesulfonamide IUPAC Name: 1-(4-methylphenyl)-N-[(1-propan-2-ylpiperidin-1-ium-4-yl)methyl]methanesulfonamide Traditional Name: N-[(1-isopropylpiperidin-1-ium-4-yl)methyl]-1-(p-tolyl)methanesulfonamide Formula: C17H29N2O2S+ MolecularWeight: 325.48936

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CS(=O)(=O)NCC2CC[NH+](CC2)C(C)C

Isomeric SMILES

CC1=CC=C(C=C1)CS(=O)(=O)NCC2CC[NH+](CC2)C(C)C

InChI

InChI=1S/C17H28N2O2S/c1-14(2)19-10-8-16(9-11-19)12-18-22(20,21)13-17-6-4-15(3)5-7-17/h4-7,14,16,18H,8-13H2,1-3H3/p+1