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

Systemtic Name: ethyl (3R)-3-[(2-methylphenyl)methyl]-1-(2-methylsulfanylethanoyl)piperidine-3-carboxylate Openeye Name: ethyl (3R)-1-(2-methylsulfanylacetyl)-3-(o-tolylmethyl)piperidine-3-carboxylate CAS Name: (3R)-3-[(2-methylphenyl)methyl]-1-[2-(methylthio)-1-oxoethyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl (3R)-3-[(2-methylphenyl)methyl]-1-(2-methylsulfanylacetyl)piperidine-3-carboxylate Traditional Name: (3R)-3-(2-methylbenzyl)-1-[2-(methylthio)acetyl]nipecotic acid ethyl ester Formula: C19H27NO3S MolecularWeight: 349.48758

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCCN(C1)C(=O)CSC)CC2=CC=CC=C2C

Isomeric SMILES

CCOC(=O)[C@]1(CCCN(C1)C(=O)CSC)CC2=CC=CC=C2C

InChI

InChI=1S/C19H27NO3S/c1-4-23-18(22)19(12-16-9-6-5-8-15(16)2)10-7-11-20(14-19)17(21)13-24-3/h5-6,8-9H,4,7,10-14H2,1-3H3/t19-/m1/s1