4-[(3S)-3-methylpiperidin-1-ium-1-yl]-1-(phenylsulfonyl)piperidine

Systemtic Name: 4-[(3S)-3-methylpiperidin-1-ium-1-yl]-1-(phenylsulfonyl)piperidine Openeye Name: 1-(benzenesulfonyl)-4-[(3S)-3-methylpiperidin-1-ium-1-yl]piperidine CAS Name: 1-(benzenesulfonyl)-4-[(3S)-3-methyl-1-piperidin-1-iumyl]piperidine IUPAC Name: 1-(benzenesulfonyl)-4-[(3S)-3-methylpiperidin-1-ium-1-yl]piperidine Traditional Name: 1-besyl-4-[(3S)-3-methylpiperidin-1-ium-1-yl]piperidine Formula: C17H27N2O2S+ MolecularWeight: 323.47348

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC[NH+](C1)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C[C@H]1CCC[NH+](C1)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C17H26N2O2S/c1-15-6-5-11-18(14-15)16-9-12-19(13-10-16)22(20,21)17-7-3-2-4-8-17/h2-4,7-8,15-16H,5-6,9-14H2,1H3/p+1/t15-/m0/s1