(2S)-2-[(2R)-3-ethanoyl-2-(4-nitrophenyl)-4-oxidanidyl-5-oxidanylidene-2H-pyrrol-1-yl]propanoate

Systemtic Name: (2S)-2-[(2R)-3-ethanoyl-2-(4-nitrophenyl)-4-oxidanidyl-5-oxidanylidene-2H-pyrrol-1-yl]propanoate Openeye Name: (2S)-2-[(2R)-3-acetyl-2-(4-nitrophenyl)-4-oxido-5-oxo-2H-pyrrol-1-yl]propanoate CAS Name: (2S)-2-[(2R)-3-acetyl-2-(4-nitrophenyl)-4-oxido-5-oxo-2H-pyrrol-1-yl]propanoate IUPAC Name: (2S)-2-[(2R)-3-acetyl-2-(4-nitrophenyl)-4-oxido-5-oxo-2H-pyrrol-1-yl]propanoate Traditional Name: (2S)-2-[(5R)-4-acetyl-2-keto-5-(4-nitrophenyl)-3-oxido-3-pyrrolin-1-yl]propionate Formula: C15H12N2O7-2 MolecularWeight: 332.26498

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)[O-])N1C(C(=C(C1=O)[O-])C(=O)C)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C[C@@H](C(=O)[O-])N1[C@@H](C(=C(C1=O)[O-])C(=O)C)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C15H14N2O7/c1-7(15(21)22)16-12(11(8(2)18)13(19)14(16)20)9-3-5-10(6-4-9)17(23)24/h3-7,12,19H,1-2H3,(H,21,22)/p-2/t7-,12+/m0/s1