[(3R,4S)-1-methyl-4-phenyl-piperidin-3-yl]methyl benzenesulfonate

Systemtic Name: [(3R,4S)-1-methyl-4-phenyl-piperidin-3-yl]methyl benzenesulfonate Openeye Name: [(3R,4S)-1-methyl-4-phenyl-3-piperidyl]methyl benzenesulfonate CAS Name: benzenesulfonic acid [(3R,4S)-1-methyl-4-phenyl-3-piperidinyl]methyl ester IUPAC Name: [(3R,4S)-1-methyl-4-phenylpiperidin-3-yl]methyl benzenesulfonate Traditional Name: benzenesulfonic acid [(3R,4S)-1-methyl-4-phenyl-3-piperidyl]methyl ester Formula: C19H23NO3S MolecularWeight: 345.45582

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(C(C1)COS(=O)(=O)C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CN1CC[C@@H]([C@H](C1)COS(=O)(=O)C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C19H23NO3S/c1-20-13-12-19(16-8-4-2-5-9-16)17(14-20)15-23-24(21,22)18-10-6-3-7-11-18/h2-11,17,19H,12-15H2,1H3/t17-,19-/m1/s1