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

Systemtic Name: 4-[(E)-3-(3-fluoranyl-4-methoxy-phenyl)-3-oxidanylidene-prop-1-enyl]-2-nitro-phenolate Openeye Name: 4-[(E)-3-(3-fluoro-4-methoxy-phenyl)-3-oxo-prop-1-enyl]-2-nitro-phenolate CAS Name: 4-[(E)-3-(3-fluoro-4-methoxyphenyl)-3-oxoprop-1-enyl]-2-nitrophenolate IUPAC Name: 4-[(E)-3-(3-fluoro-4-methoxyphenyl)-3-oxoprop-1-enyl]-2-nitrophenolate Traditional Name: 4-[(E)-3-(3-fluoro-4-methoxy-phenyl)-3-keto-prop-1-enyl]-2-nitro-phenolate Formula: C16H11FNO5- MolecularWeight: 316.260643

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)C=CC2=CC(=C(C=C2)[O-])[N+](=O)[O-])F

Isomeric SMILES

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

InChI

InChI=1S/C16H12FNO5/c1-23-16-7-4-11(9-12(16)17)14(19)5-2-10-3-6-15(20)13(8-10)18(21)22/h2-9,20H,1H3/p-1/b5-2+