ethyl 1-(3-methylsulfanylpropyl)-4-(oxan-2-ylmethyl)piperidine-4-carboxylate

Systemtic Name: ethyl 1-(3-methylsulfanylpropyl)-4-(oxan-2-ylmethyl)piperidine-4-carboxylate Openeye Name: ethyl 1-(3-methylsulfanylpropyl)-4-(tetrahydropyran-2-ylmethyl)piperidine-4-carboxylate CAS Name: 1-[3-(methylthio)propyl]-4-(2-oxanylmethyl)-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(3-methylsulfanylpropyl)-4-(oxan-2-ylmethyl)piperidine-4-carboxylate Traditional Name: 1-[3-(methylthio)propyl]-4-(tetrahydropyran-2-ylmethyl)isonipecotic acid ethyl ester Formula: C18H33NO3S MolecularWeight: 343.52452

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCN(CC1)CCCSC)CC2CCCCO2

Isomeric SMILES

CCOC(=O)C1(CCN(CC1)CCCSC)CC2CCCCO2

InChI

InChI=1S/C18H33NO3S/c1-3-21-17(20)18(15-16-7-4-5-13-22-16)8-11-19(12-9-18)10-6-14-23-2/h16H,3-15H2,1-2H3