ethyl 1-(3-methylsulfanylpropanoyl)-4-[[(2R)-oxan-2-yl]methyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-(3-methylsulfanylpropanoyl)-4-[[(2R)-oxan-2-yl]methyl]piperidine-4-carboxylate Openeye Name: ethyl 1-(3-methylsulfanylpropanoyl)-4-[[(2R)-tetrahydropyran-2-yl]methyl]piperidine-4-carboxylate CAS Name: 1-[3-(methylthio)-1-oxopropyl]-4-[[(2R)-2-oxanyl]methyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(3-methylsulfanylpropanoyl)-4-[[(2R)-oxan-2-yl]methyl]piperidine-4-carboxylate Traditional Name: 1-[3-(methylthio)propanoyl]-4-[[(2R)-tetrahydropyran-2-yl]methyl]isonipecotic acid ethyl ester Formula: C18H31NO4S MolecularWeight: 357.50804

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCN(CC1)C(=O)CCSC)CC2CCCCO2

Isomeric SMILES

CCOC(=O)C1(CCN(CC1)C(=O)CCSC)C[C@H]2CCCCO2

InChI

InChI=1S/C18H31NO4S/c1-3-22-17(21)18(14-15-6-4-5-12-23-15)8-10-19(11-9-18)16(20)7-13-24-2/h15H,3-14H2,1-2H3/t15-/m1/s1