(3R)-3-methyl-1-[2-(phenylsulfonyl)ethyl]piperidin-1-ium

Systemtic Name: (3R)-3-methyl-1-[2-(phenylsulfonyl)ethyl]piperidin-1-ium Openeye Name: (3R)-1-[2-(benzenesulfonyl)ethyl]-3-methyl-piperidin-1-ium CAS Name: (3R)-1-[2-(benzenesulfonyl)ethyl]-3-methylpiperidin-1-ium IUPAC Name: (3R)-1-[2-(benzenesulfonyl)ethyl]-3-methylpiperidin-1-ium Traditional Name: (3R)-1-(2-besylethyl)-3-methyl-piperidin-1-ium Formula: C14H22NO2S+ MolecularWeight: 268.39498

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC[NH+](C1)CCS(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

C[C@@H]1CCC[NH+](C1)CCS(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C14H21NO2S/c1-13-6-5-9-15(12-13)10-11-18(16,17)14-7-3-2-4-8-14/h2-4,7-8,13H,5-6,9-12H2,1H3/p+1/t13-/m1/s1