(2S)-2-(4-chlorophenyl)sulfonyl-1-phenyl-3-piperidin-1-ium-1-yl-propan-1-one

Systemtic Name: (2S)-2-(4-chlorophenyl)sulfonyl-1-phenyl-3-piperidin-1-ium-1-yl-propan-1-one Openeye Name: (2S)-2-(4-chlorophenyl)sulfonyl-1-phenyl-3-piperidin-1-ium-1-yl-propan-1-one CAS Name: (2S)-2-(4-chlorophenyl)sulfonyl-1-phenyl-3-(1-piperidin-1-iumyl)-1-propanone IUPAC Name: (2S)-2-(4-chlorophenyl)sulfonyl-1-phenyl-3-piperidin-1-ium-1-ylpropan-1-one Traditional Name: (2S)-2-(4-chlorophenyl)sulfonyl-1-phenyl-3-piperidin-1-ium-1-yl-propan-1-one Formula: C20H23ClNO3S+ MolecularWeight: 392.91952

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC(C(=O)C2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1CC[NH+](CC1)C[C@@H](C(=O)C2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H22ClNO3S/c21-17-9-11-18(12-10-17)26(24,25)19(15-22-13-5-2-6-14-22)20(23)16-7-3-1-4-8-16/h1,3-4,7-12,19H,2,5-6,13-15H2/p+1/t19-/m0/s1