methyl (2R)-3-(2-methoxy-2-oxidanylidene-ethyl)sulfanyl-2-[(2-methylpropan-2-yl)oxycarbonyl-(4-nitrophenyl)carbonyl-amino]propanoate

Systemtic Name: methyl (2R)-3-(2-methoxy-2-oxidanylidene-ethyl)sulfanyl-2-[(2-methylpropan-2-yl)oxycarbonyl-(4-nitrophenyl)carbonyl-amino]propanoate Openeye Name: methyl (2R)-2-[tert-butoxycarbonyl-(4-nitrobenzoyl)amino]-3-(2-methoxy-2-oxo-ethyl)sulfanyl-propanoate CAS Name: (2R)-3-[(2-methoxy-2-oxoethyl)thio]-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]-[(4-nitrophenyl)-oxomethyl]amino]propanoic acid methyl ester IUPAC Name: methyl (2R)-3-(2-methoxy-2-oxoethyl)sulfanyl-2-[(2-methylpropan-2-yl)oxycarbonyl-(4-nitrobenzoyl)amino]propanoate Traditional Name: (2R)-2-[tert-butoxycarbonyl-(4-nitrobenzoyl)amino]-3-[(2-keto-2-methoxy-ethyl)thio]propionic acid methyl ester Formula: C19H24N2O9S MolecularWeight: 456.46686

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N(C(CSCC(=O)OC)C(=O)OC)C(=O)C1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)N([C@@H](CSCC(=O)OC)C(=O)OC)C(=O)C1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C19H24N2O9S/c1-19(2,3)30-18(25)20(14(17(24)29-5)10-31-11-15(22)28-4)16(23)12-6-8-13(9-7-12)21(26)27/h6-9,14H,10-11H2,1-5H3/t14-/m0/s1