4-(2-ethanoyl-3-oxidanylidene-but-1-enyl)-2-nitro-6-oxidanyl-phenolate

Systemtic Name: 4-(2-ethanoyl-3-oxidanylidene-but-1-enyl)-2-nitro-6-oxidanyl-phenolate Openeye Name: 4-(2-acetyl-3-oxo-but-1-enyl)-2-hydroxy-6-nitro-phenolate CAS Name: 4-(2-acetyl-3-oxobut-1-enyl)-2-hydroxy-6-nitrophenolate IUPAC Name: 4-(2-acetyl-3-oxobut-1-enyl)-2-hydroxy-6-nitrophenolate Traditional Name: 4-(2-acetyl-3-keto-but-1-enyl)-2-hydroxy-6-nitro-phenolate Formula: C12H10NO6- MolecularWeight: 264.2109

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(=CC1=CC(=C(C(=C1)O)[O-])[N+](=O)[O-])C(=O)C

Isomeric SMILES

CC(=O)C(=CC1=CC(=C(C(=C1)O)[O-])[N+](=O)[O-])C(=O)C

InChI

InChI=1S/C12H11NO6/c1-6(14)9(7(2)15)3-8-4-10(13(18)19)12(17)11(16)5-8/h3-5,16-17H,1-2H3/p-1