methyl 4-(2-methoxy-2-oxidanylidene-ethanoyl)sulfanyl-2-(phenylmethoxycarbonylamino)butanoate

Systemtic Name: methyl 4-(2-methoxy-2-oxidanylidene-ethanoyl)sulfanyl-2-(phenylmethoxycarbonylamino)butanoate Openeye Name: methyl 2-(benzyloxycarbonylamino)-4-(2-methoxy-2-oxo-acetyl)sulfanyl-butanoate CAS Name: 4-[(2-methoxy-1,2-dioxoethyl)thio]-2-(phenylmethoxycarbonylamino)butanoic acid methyl ester IUPAC Name: methyl 4-(2-methoxy-2-oxoacetyl)sulfanyl-2-(phenylmethoxycarbonylamino)butanoate Traditional Name: 2-(benzyloxycarbonylamino)-4-(methoxalylthio)butyric acid methyl ester Formula: C16H19NO7S MolecularWeight: 369.38956

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CCSC(=O)C(=O)OC)NC(=O)OCC1=CC=CC=C1

Isomeric SMILES

COC(=O)C(CCSC(=O)C(=O)OC)NC(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C16H19NO7S/c1-22-13(18)12(8-9-25-15(20)14(19)23-2)17-16(21)24-10-11-6-4-3-5-7-11/h3-7,12H,8-10H2,1-2H3,(H,17,21)