methyl (2S,3R)-2-[(4-nitrophenyl)methoxycarbonylamino]-3-oxidanyl-butanoate

Systemtic Name: methyl (2S,3R)-2-[(4-nitrophenyl)methoxycarbonylamino]-3-oxidanyl-butanoate Openeye Name: methyl (2S,3R)-3-hydroxy-2-[(4-nitrophenyl)methoxycarbonylamino]butanoate CAS Name: (2S,3R)-3-hydroxy-2-[[(4-nitrophenyl)methoxy-oxomethyl]amino]butanoic acid methyl ester IUPAC Name: methyl (2S,3R)-3-hydroxy-2-[(4-nitrophenyl)methoxycarbonylamino]butanoate Traditional Name: (2S,3R)-3-hydroxy-2-[(4-nitrobenzyl)oxycarbonylamino]butyric acid methyl ester Formula: C13H16N2O7 MolecularWeight: 312.27534

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C(=O)OC)NC(=O)OCC1=CC=C(C=C1)[N+](=O)[O-])O

Isomeric SMILES

C[C@H]([C@@H](C(=O)OC)NC(=O)OCC1=CC=C(C=C1)[N+](=O)[O-])O

InChI

InChI=1S/C13H16N2O7/c1-8(16)11(12(17)21-2)14-13(18)22-7-9-3-5-10(6-4-9)15(19)20/h3-6,8,11,16H,7H2,1-2H3,(H,14,18)/t8-,11+/m1/s1