(phenylmethyl) 3-[1-(2-methoxy-4-methylsulfanyl-phenyl)carbonylpiperidin-4-yl]-2-oxidanylidene-1,3-oxazolidine-4-carboxylate

Systemtic Name: (phenylmethyl) 3-[1-(2-methoxy-4-methylsulfanyl-phenyl)carbonylpiperidin-4-yl]-2-oxidanylidene-1,3-oxazolidine-4-carboxylate Openeye Name: benzyl 3-[1-(2-methoxy-4-methylsulfanyl-benzoyl)-4-piperidyl]-2-oxo-oxazolidine-4-carboxylate CAS Name: 3-[1-[[2-methoxy-4-(methylthio)phenyl]-oxomethyl]-4-piperidinyl]-2-oxo-4-oxazolidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 3-[1-(2-methoxy-4-methylsulfanylbenzoyl)piperidin-4-yl]-2-oxo-1,3-oxazolidine-4-carboxylate Traditional Name: 2-keto-3-[1-[2-methoxy-4-(methylthio)benzoyl]-4-piperidyl]oxazolidine-4-carboxylic acid benzyl ester Formula: C25H28N2O6S MolecularWeight: 484.56462

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)SC)C(=O)N2CCC(CC2)N3C(COC3=O)C(=O)OCC4=CC=CC=C4

Isomeric SMILES

COC1=C(C=CC(=C1)SC)C(=O)N2CCC(CC2)N3C(COC3=O)C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C25H28N2O6S/c1-31-22-14-19(34-2)8-9-20(22)23(28)26-12-10-18(11-13-26)27-21(16-33-25(27)30)24(29)32-15-17-6-4-3-5-7-17/h3-9,14,18,21H,10-13,15-16H2,1-2H3