[(2R)-1-(methoxycarbonylamino)-1-oxidanylidene-propan-2-yl] 2-(2-nitrophenyl)sulfanylethanoate

Systemtic Name: [(2R)-1-(methoxycarbonylamino)-1-oxidanylidene-propan-2-yl] 2-(2-nitrophenyl)sulfanylethanoate Openeye Name: [(1R)-2-(methoxycarbonylamino)-1-methyl-2-oxo-ethyl] 2-(2-nitrophenyl)sulfanylacetate CAS Name: 2-[(2-nitrophenyl)thio]acetic acid [(2R)-1-(methoxycarbonylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(methoxycarbonylamino)-1-oxopropan-2-yl] 2-(2-nitrophenyl)sulfanylacetate Traditional Name: 2-[(2-nitrophenyl)thio]acetic acid [(1R)-2-(carbomethoxyamino)-2-keto-1-methyl-ethyl] ester Formula: C13H14N2O7S MolecularWeight: 342.32446

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)OC)OC(=O)CSC1=CC=CC=C1[N+](=O)[O-]

Isomeric SMILES

C[C@H](C(=O)NC(=O)OC)OC(=O)CSC1=CC=CC=C1[N+](=O)[O-]

InChI

InChI=1S/C13H14N2O7S/c1-8(12(17)14-13(18)21-2)22-11(16)7-23-10-6-4-3-5-9(10)15(19)20/h3-6,8H,7H2,1-2H3,(H,14,17,18)/t8-/m1/s1