methyl (2R,3S)-4-nitro-2-oxidanyl-3-phenyl-butanoate

Systemtic Name: methyl (2R,3S)-4-nitro-2-oxidanyl-3-phenyl-butanoate Openeye Name: methyl (2R,3S)-2-hydroxy-4-nitro-3-phenyl-butanoate CAS Name: (2R,3S)-2-hydroxy-4-nitro-3-phenylbutanoic acid methyl ester IUPAC Name: methyl (2R,3S)-2-hydroxy-4-nitro-3-phenylbutanoate Traditional Name: (2R,3S)-2-hydroxy-4-nitro-3-phenyl-butyric acid methyl ester Formula: C11H13NO5 MolecularWeight: 239.22462

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H13NO5/c1-17-11(14)10(13)9(7-12(15)16)8-5-3-2-4-6-8/h2-6,9-10,13H,7H2,1H3/t9-,10-/m1/s1