1-(2-cyanophenyl)-N-methyl-N-(1-methylpiperidin-1-ium-4-yl)methanesulfonamide

Systemtic Name: 1-(2-cyanophenyl)-N-methyl-N-(1-methylpiperidin-1-ium-4-yl)methanesulfonamide Openeye Name: 1-(2-cyanophenyl)-N-methyl-N-(1-methylpiperidin-1-ium-4-yl)methanesulfonamide CAS Name: 1-(2-cyanophenyl)-N-methyl-N-(1-methyl-4-piperidin-1-iumyl)methanesulfonamide IUPAC Name: 1-(2-cyanophenyl)-N-methyl-N-(1-methylpiperidin-1-ium-4-yl)methanesulfonamide Traditional Name: 1-(2-cyanophenyl)-N-methyl-N-(1-methylpiperidin-1-ium-4-yl)methanesulfonamide Formula: C15H22N3O2S+ MolecularWeight: 308.41908

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)N(C)S(=O)(=O)CC2=CC=CC=C2C#N

Isomeric SMILES

C[NH+]1CCC(CC1)N(C)S(=O)(=O)CC2=CC=CC=C2C#N

InChI

InChI=1S/C15H21N3O2S/c1-17-9-7-15(8-10-17)18(2)21(19,20)12-14-6-4-3-5-13(14)11-16/h3-6,15H,7-10,12H2,1-2H3/p+1