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

Systemtic Name: 2-methoxy-6-nitro-4-[(E)-3-oxidanylidene-3-(4-phenylphenyl)prop-1-enyl]phenolate Openeye Name: 2-methoxy-6-nitro-4-[(E)-3-oxo-3-(4-phenylphenyl)prop-1-enyl]phenolate CAS Name: 2-methoxy-6-nitro-4-[(E)-3-oxo-3-(4-phenylphenyl)prop-1-enyl]phenolate IUPAC Name: 2-methoxy-6-nitro-4-[(E)-3-oxo-3-(4-phenylphenyl)prop-1-enyl]phenolate Traditional Name: 4-[(E)-3-keto-3-(4-phenylphenyl)prop-1-enyl]-2-methoxy-6-nitro-phenolate Formula: C22H16NO5- MolecularWeight: 374.36614

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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)C3=CC=CC=C3

Isomeric SMILES

COC1=CC(=CC(=C1[O-])[N+](=O)[O-])/C=C/C(=O)C2=CC=C(C=C2)C3=CC=CC=C3

InChI

InChI=1S/C22H17NO5/c1-28-21-14-15(13-19(22(21)25)23(26)27)7-12-20(24)18-10-8-17(9-11-18)16-5-3-2-4-6-16/h2-14,25H,1H3/p-1/b12-7+