(2R,3S)-2-[(4-methoxy-3-nitro-phenyl)carbonylamino]-3-oxidanyl-butanoate

Systemtic Name: (2R,3S)-2-[(4-methoxy-3-nitro-phenyl)carbonylamino]-3-oxidanyl-butanoate Openeye Name: (2R,3S)-3-hydroxy-2-[(4-methoxy-3-nitro-benzoyl)amino]butanoate CAS Name: (2R,3S)-3-hydroxy-2-[[(4-methoxy-3-nitrophenyl)-oxomethyl]amino]butanoate IUPAC Name: (2R,3S)-3-hydroxy-2-[(4-methoxy-3-nitrobenzoyl)amino]butanoate Traditional Name: (2R,3S)-3-hydroxy-2-[(4-methoxy-3-nitro-benzoyl)amino]butyrate Formula: C12H13N2O7- MolecularWeight: 297.24082

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H14N2O7/c1-6(15)10(12(17)18)13-11(16)7-3-4-9(21-2)8(5-7)14(19)20/h3-6,10,15H,1-2H3,(H,13,16)(H,17,18)/p-1/t6-,10+/m0/s1