ethyl (3R)-3-[(3-methoxyphenyl)methyl]-1-(2-methylsulfanylethanoyl)piperidine-3-carboxylate

Systemtic Name: ethyl (3R)-3-[(3-methoxyphenyl)methyl]-1-(2-methylsulfanylethanoyl)piperidine-3-carboxylate Openeye Name: ethyl (3R)-3-[(3-methoxyphenyl)methyl]-1-(2-methylsulfanylacetyl)piperidine-3-carboxylate CAS Name: (3R)-3-[(3-methoxyphenyl)methyl]-1-[2-(methylthio)-1-oxoethyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl (3R)-3-[(3-methoxyphenyl)methyl]-1-(2-methylsulfanylacetyl)piperidine-3-carboxylate Traditional Name: (3R)-3-m-anisyl-1-[2-(methylthio)acetyl]nipecotic acid ethyl ester Formula: C19H27NO4S MolecularWeight: 365.48698

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCCN(C1)C(=O)CSC)CC2=CC(=CC=C2)OC

Isomeric SMILES

CCOC(=O)[C@]1(CCCN(C1)C(=O)CSC)CC2=CC(=CC=C2)OC

InChI

InChI=1S/C19H27NO4S/c1-4-24-18(22)19(12-15-7-5-8-16(11-15)23-2)9-6-10-20(14-19)17(21)13-25-3/h5,7-8,11H,4,6,9-10,12-14H2,1-3H3/t19-/m1/s1