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

Systemtic Name: 1-[(2S)-1-naphthalen-2-ylsulfonyl-3-piperidin-1-ium-1-yl-propan-2-yl]piperidine Openeye Name: 1-[(1S)-1-(2-naphthylsulfonylmethyl)-2-piperidin-1-ium-1-yl-ethyl]piperidine CAS Name: 1-[(2S)-1-(2-naphthalenylsulfonyl)-3-(1-piperidin-1-iumyl)propan-2-yl]piperidine IUPAC Name: 1-[(2S)-1-naphthalen-2-ylsulfonyl-3-piperidin-1-ium-1-ylpropan-2-yl]piperidine Traditional Name: 1-[(1S)-1-(2-naphthylsulfonylmethyl)-2-piperidin-1-ium-1-yl-ethyl]piperidine Formula: C23H33N2O2S+ MolecularWeight: 401.58532

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC(CS(=O)(=O)C2=CC3=CC=CC=C3C=C2)N4CCCCC4

Isomeric SMILES

C1CC[NH+](CC1)C[C@@H](CS(=O)(=O)C2=CC3=CC=CC=C3C=C2)N4CCCCC4

InChI

InChI=1S/C23H32N2O2S/c26-28(27,23-12-11-20-9-3-4-10-21(20)17-23)19-22(25-15-7-2-8-16-25)18-24-13-5-1-6-14-24/h3-4,9-12,17,22H,1-2,5-8,13-16,18-19H2/p+1/t22-/m0/s1