2-methoxy-4-[(E)-3-(3-methoxy-4-oxidanyl-phenyl)-3-oxidanylidene-prop-1-enyl]-6-nitro-phenolate

Systemtic Name: 2-methoxy-4-[(E)-3-(3-methoxy-4-oxidanyl-phenyl)-3-oxidanylidene-prop-1-enyl]-6-nitro-phenolate Openeye Name: 4-[(E)-3-(4-hydroxy-3-methoxy-phenyl)-3-oxo-prop-1-enyl]-2-methoxy-6-nitro-phenolate CAS Name: 4-[(E)-3-(4-hydroxy-3-methoxyphenyl)-3-oxoprop-1-enyl]-2-methoxy-6-nitrophenolate IUPAC Name: 4-[(E)-3-(4-hydroxy-3-methoxyphenyl)-3-oxoprop-1-enyl]-2-methoxy-6-nitrophenolate Traditional Name: 4-[(E)-3-(4-hydroxy-3-methoxy-phenyl)-3-keto-prop-1-enyl]-2-methoxy-6-nitro-phenolate Formula: C17H14NO7- MolecularWeight: 344.29556

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1[O-])[N+](=O)[O-])C=CC(=O)C2=CC(=C(C=C2)O)OC

Isomeric SMILES

COC1=CC(=CC(=C1[O-])[N+](=O)[O-])/C=C/C(=O)C2=CC(=C(C=C2)O)OC

InChI

InChI=1S/C17H15NO7/c1-24-15-9-11(4-6-14(15)20)13(19)5-3-10-7-12(18(22)23)17(21)16(8-10)25-2/h3-9,20-21H,1-2H3/p-1/b5-3+