2-[4-ethoxy-1-oxidanyl-3,4-bis(oxidanylidene)but-1-enyl]-4-methyl-6-nitro-phenolate

Systemtic Name: 2-[4-ethoxy-1-oxidanyl-3,4-bis(oxidanylidene)but-1-enyl]-4-methyl-6-nitro-phenolate Openeye Name: 2-(4-ethoxy-1-hydroxy-3,4-dioxo-but-1-enyl)-4-methyl-6-nitro-phenolate CAS Name: 2-(4-ethoxy-1-hydroxy-3,4-dioxobut-1-enyl)-4-methyl-6-nitrophenolate IUPAC Name: 2-(4-ethoxy-1-hydroxy-3,4-dioxobut-1-enyl)-4-methyl-6-nitrophenolate Traditional Name: 2-(4-ethoxy-1-hydroxy-3,4-diketo-but-1-enyl)-4-methyl-6-nitro-phenolate Formula: C13H12NO7- MolecularWeight: 294.23688

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H13NO7/c1-3-21-13(18)11(16)6-10(15)8-4-7(2)5-9(12(8)17)14(19)20/h4-6,15,17H,3H2,1-2H3/p-1