ethyl 4-[(3-fluorophenyl)methyl]-1-[(2R)-1-methylsulfanylpropan-2-yl]piperidine-4-carboxylate

Systemtic Name: ethyl 4-[(3-fluorophenyl)methyl]-1-[(2R)-1-methylsulfanylpropan-2-yl]piperidine-4-carboxylate Openeye Name: ethyl 4-[(3-fluorophenyl)methyl]-1-[(1R)-1-methyl-2-methylsulfanyl-ethyl]piperidine-4-carboxylate CAS Name: 4-[(3-fluorophenyl)methyl]-1-[(2R)-1-(methylthio)propan-2-yl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(3-fluorophenyl)methyl]-1-[(2R)-1-methylsulfanylpropan-2-yl]piperidine-4-carboxylate Traditional Name: 4-(3-fluorobenzyl)-1-[(1R)-1-methyl-2-(methylthio)ethyl]isonipecotic acid ethyl ester Formula: C19H28FNO2S MolecularWeight: 353.494523

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCN(CC1)C(C)CSC)CC2=CC(=CC=C2)F

Isomeric SMILES

CCOC(=O)C1(CCN(CC1)[C@H](C)CSC)CC2=CC(=CC=C2)F

InChI

InChI=1S/C19H28FNO2S/c1-4-23-18(22)19(13-16-6-5-7-17(20)12-16)8-10-21(11-9-19)15(2)14-24-3/h5-7,12,15H,4,8-11,13-14H2,1-3H3/t15-/m1/s1