1-[(2S)-1-(phenylsulfonyl)-3-piperidin-1-ium-1-yl-propan-2-yl]piperidine

Systemtic Name: 1-[(2S)-1-(phenylsulfonyl)-3-piperidin-1-ium-1-yl-propan-2-yl]piperidine Openeye Name: 1-[(1S)-1-(benzenesulfonylmethyl)-2-piperidin-1-ium-1-yl-ethyl]piperidine CAS Name: 1-[(2S)-1-(benzenesulfonyl)-3-(1-piperidin-1-iumyl)propan-2-yl]piperidine IUPAC Name: 1-[(2S)-1-(benzenesulfonyl)-3-piperidin-1-ium-1-ylpropan-2-yl]piperidine Traditional Name: 1-[(1S)-1-(besylmethyl)-2-piperidin-1-ium-1-yl-ethyl]piperidine Formula: C19H31N2O2S+ MolecularWeight: 351.52664

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC(CS(=O)(=O)C2=CC=CC=C2)N3CCCCC3

Isomeric SMILES

C1CC[NH+](CC1)C[C@@H](CS(=O)(=O)C2=CC=CC=C2)N3CCCCC3

InChI

InChI=1S/C19H30N2O2S/c22-24(23,19-10-4-1-5-11-19)17-18(21-14-8-3-9-15-21)16-20-12-6-2-7-13-20/h1,4-5,10-11,18H,2-3,6-9,12-17H2/p+1/t18-/m0/s1