6-[(2S)-3-ethanoyl-2-(4-nitrophenyl)-4-oxidanidyl-5-oxidanylidene-2H-pyrrol-1-yl]hexanoate

Systemtic Name: 6-[(2S)-3-ethanoyl-2-(4-nitrophenyl)-4-oxidanidyl-5-oxidanylidene-2H-pyrrol-1-yl]hexanoate Openeye Name: 6-[(2S)-3-acetyl-2-(4-nitrophenyl)-4-oxido-5-oxo-2H-pyrrol-1-yl]hexanoate CAS Name: 6-[(2S)-3-acetyl-2-(4-nitrophenyl)-4-oxido-5-oxo-2H-pyrrol-1-yl]hexanoate IUPAC Name: 6-[(2S)-3-acetyl-2-(4-nitrophenyl)-4-oxido-5-oxo-2H-pyrrol-1-yl]hexanoate Traditional Name: 6-[(5S)-4-acetyl-2-keto-5-(4-nitrophenyl)-3-oxido-3-pyrrolin-1-yl]hexanoate Formula: C18H18N2O7-2 MolecularWeight: 374.34472

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(C(=O)N(C1C2=CC=C(C=C2)[N+](=O)[O-])CCCCCC(=O)[O-])[O-]

Isomeric SMILES

CC(=O)C1=C(C(=O)N([C@H]1C2=CC=C(C=C2)[N+](=O)[O-])CCCCCC(=O)[O-])[O-]

InChI

InChI=1S/C18H20N2O7/c1-11(21)15-16(12-6-8-13(9-7-12)20(26)27)19(18(25)17(15)24)10-4-2-3-5-14(22)23/h6-9,16,24H,2-5,10H2,1H3,(H,22,23)/p-2/t16-/m0/s1