1-(1-methylsulfonylpiperidin-4-yl)-4-(phenylmethyl)piperazin-1-ium

Systemtic Name: 1-(1-methylsulfonylpiperidin-4-yl)-4-(phenylmethyl)piperazin-1-ium Openeye Name: 1-benzyl-4-(1-methylsulfonyl-4-piperidyl)piperazin-4-ium CAS Name: 1-(1-methylsulfonyl-4-piperidinyl)-4-(phenylmethyl)piperazin-1-ium IUPAC Name: 1-benzyl-4-(1-methylsulfonylpiperidin-4-yl)piperazin-4-ium Traditional Name: 1-benzyl-4-(1-mesyl-4-piperidyl)piperazin-4-ium Formula: C17H28N3O2S+ MolecularWeight: 338.48812

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCC(CC1)[NH+]2CCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

CS(=O)(=O)N1CCC(CC1)[NH+]2CCN(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C17H27N3O2S/c1-23(21,22)20-9-7-17(8-10-20)19-13-11-18(12-14-19)15-16-5-3-2-4-6-16/h2-6,17H,7-15H2,1H3/p+1