1-methyl-4-[1-(phenylmethyl)sulfonylpiperidin-4-yl]piperazin-1-ium

Systemtic Name: 1-methyl-4-[1-(phenylmethyl)sulfonylpiperidin-4-yl]piperazin-1-ium Openeye Name: 1-(1-benzylsulfonyl-4-piperidyl)-4-methyl-piperazin-4-ium CAS Name: 1-methyl-4-[1-(phenylmethyl)sulfonyl-4-piperidinyl]piperazin-1-ium IUPAC Name: 1-(1-benzylsulfonylpiperidin-4-yl)-4-methylpiperazin-4-ium Traditional Name: 1-(1-benzylsulfonyl-4-piperidyl)-4-methyl-piperazin-4-ium Formula: C17H28N3O2S+ MolecularWeight: 338.48812

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2CCN(CC2)S(=O)(=O)CC3=CC=CC=C3

Isomeric SMILES

C[NH+]1CCN(CC1)C2CCN(CC2)S(=O)(=O)CC3=CC=CC=C3

InChI

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