methyl 4-methylsulfanyl-2-[[4-[2-oxidanylidene-5-(phenoxymethyl)-1,3-oxazolidin-3-yl]piperidin-1-yl]carbonylamino]butanoate

Systemtic Name: methyl 4-methylsulfanyl-2-[[4-[2-oxidanylidene-5-(phenoxymethyl)-1,3-oxazolidin-3-yl]piperidin-1-yl]carbonylamino]butanoate Openeye Name: methyl 4-methylsulfanyl-2-[[4-[2-oxo-5-(phenoxymethyl)oxazolidin-3-yl]piperidine-1-carbonyl]amino]butanoate CAS Name: 4-(methylthio)-2-[[oxo-[4-[2-oxo-5-(phenoxymethyl)-3-oxazolidinyl]-1-piperidinyl]methyl]amino]butanoic acid methyl ester IUPAC Name: methyl 4-methylsulfanyl-2-[[4-[2-oxo-5-(phenoxymethyl)-1,3-oxazolidin-3-yl]piperidine-1-carbonyl]amino]butanoate Traditional Name: 2-[[4-[2-keto-5-(phenoxymethyl)oxazolidin-3-yl]piperidine-1-carbonyl]amino]-4-(methylthio)butyric acid methyl ester Formula: C22H31N3O6S MolecularWeight: 465.56304

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CCSC)NC(=O)N1CCC(CC1)N2CC(OC2=O)COC3=CC=CC=C3

Isomeric SMILES

COC(=O)C(CCSC)NC(=O)N1CCC(CC1)N2CC(OC2=O)COC3=CC=CC=C3

InChI

InChI=1S/C22H31N3O6S/c1-29-20(26)19(10-13-32-2)23-21(27)24-11-8-16(9-12-24)25-14-18(31-22(25)28)15-30-17-6-4-3-5-7-17/h3-7,16,18-19H,8-15H2,1-2H3,(H,23,27)