[(S)-(2-methyl-1,3-dioxolan-2-yl)-[(3R)-2-oxidanylidene-1-phenyl-piperidin-3-yl]methyl] methanesulfonate

Systemtic Name: [(S)-(2-methyl-1,3-dioxolan-2-yl)-[(3R)-2-oxidanylidene-1-phenyl-piperidin-3-yl]methyl] methanesulfonate Openeye Name: [(S)-(2-methyl-1,3-dioxolan-2-yl)-[(3R)-2-oxo-1-phenyl-3-piperidyl]methyl] methanesulfonate CAS Name: methanesulfonic acid [(S)-(2-methyl-1,3-dioxolan-2-yl)-[(3R)-2-oxo-1-phenyl-3-piperidinyl]methyl] ester IUPAC Name: [(S)-(2-methyl-1,3-dioxolan-2-yl)-[(3R)-2-oxo-1-phenylpiperidin-3-yl]methyl] methanesulfonate Traditional Name: methanesulfonic acid [(S)-[(3R)-2-keto-1-phenyl-3-piperidyl]-(2-methyl-1,3-dioxolan-2-yl)methyl] ester Formula: C17H23NO6S MolecularWeight: 369.43262

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OCCO1)C(C2CCCN(C2=O)C3=CC=CC=C3)OS(=O)(=O)C

Isomeric SMILES

CC1(OCCO1)[C@H]([C@H]2CCCN(C2=O)C3=CC=CC=C3)OS(=O)(=O)C

InChI

InChI=1S/C17H23NO6S/c1-17(22-11-12-23-17)15(24-25(2,20)21)14-9-6-10-18(16(14)19)13-7-4-3-5-8-13/h3-5,7-8,14-15H,6,9-12H2,1-2H3/t14-,15+/m1/s1