4-[(2S)-3-naphthalen-2-ylsulfonyl-2-piperidin-1-ium-1-yl-propyl]morpholine

Systemtic Name: 4-[(2S)-3-naphthalen-2-ylsulfonyl-2-piperidin-1-ium-1-yl-propyl]morpholine Openeye Name: 4-[(2S)-3-(2-naphthylsulfonyl)-2-piperidin-1-ium-1-yl-propyl]morpholine CAS Name: 4-[(2S)-3-(2-naphthalenylsulfonyl)-2-(1-piperidin-1-iumyl)propyl]morpholine IUPAC Name: 4-[(2S)-3-naphthalen-2-ylsulfonyl-2-piperidin-1-ium-1-ylpropyl]morpholine Traditional Name: 4-[(2S)-3-(2-naphthylsulfonyl)-2-piperidin-1-ium-1-yl-propyl]morpholine Formula: C22H31N2O3S+ MolecularWeight: 403.55814

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)C(CN2CCOCC2)CS(=O)(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

C1CC[NH+](CC1)[C@@H](CN2CCOCC2)CS(=O)(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C22H30N2O3S/c25-28(26,22-9-8-19-6-2-3-7-20(19)16-22)18-21(24-10-4-1-5-11-24)17-23-12-14-27-15-13-23/h2-3,6-9,16,21H,1,4-5,10-15,17-18H2/p+1/t21-/m0/s1