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

Systemtic Name: 2-methoxy-6-nitro-4-[(E)-3-oxidanylidene-3-[3-(trifluoromethyl)phenyl]prop-1-enyl]phenolate Openeye Name: 2-methoxy-6-nitro-4-[(E)-3-oxo-3-[3-(trifluoromethyl)phenyl]prop-1-enyl]phenolate CAS Name: 2-methoxy-6-nitro-4-[(E)-3-oxo-3-[3-(trifluoromethyl)phenyl]prop-1-enyl]phenolate IUPAC Name: 2-methoxy-6-nitro-4-[(E)-3-oxo-3-[3-(trifluoromethyl)phenyl]prop-1-enyl]phenolate Traditional Name: 4-[(E)-3-keto-3-[3-(trifluoromethyl)phenyl]prop-1-enyl]-2-methoxy-6-nitro-phenolate Formula: C17H11F3NO5- MolecularWeight: 366.26815

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H12F3NO5/c1-26-15-8-10(7-13(16(15)23)21(24)25)5-6-14(22)11-3-2-4-12(9-11)17(18,19)20/h2-9,23H,1H3/p-1/b6-5+