[4-[(E)-2-cyano-3-(4-fluorophenyl)-3-oxidanylidene-prop-1-enyl]-2-methoxy-phenyl] cyclopropanecarboxylate

Systemtic Name: [4-[(E)-2-cyano-3-(4-fluorophenyl)-3-oxidanylidene-prop-1-enyl]-2-methoxy-phenyl] cyclopropanecarboxylate Openeye Name: [4-[(E)-2-cyano-3-(4-fluorophenyl)-3-oxo-prop-1-enyl]-2-methoxy-phenyl] cyclopropanecarboxylate CAS Name: cyclopropanecarboxylic acid [4-[(E)-2-cyano-3-(4-fluorophenyl)-3-oxoprop-1-enyl]-2-methoxyphenyl] ester IUPAC Name: [4-[(E)-2-cyano-3-(4-fluorophenyl)-3-oxoprop-1-enyl]-2-methoxyphenyl] cyclopropanecarboxylate Traditional Name: cyclopropanecarboxylic acid [4-[(E)-2-cyano-3-(4-fluorophenyl)-3-keto-prop-1-enyl]-2-methoxy-phenyl] ester Formula: C21H16FNO4 MolecularWeight: 365.354443

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=C(C#N)C(=O)C2=CC=C(C=C2)F)OC(=O)C3CC3

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C(\C#N)/C(=O)C2=CC=C(C=C2)F)OC(=O)C3CC3

InChI

InChI=1S/C21H16FNO4/c1-26-19-11-13(2-9-18(19)27-21(25)15-3-4-15)10-16(12-23)20(24)14-5-7-17(22)8-6-14/h2,5-11,15H,3-4H2,1H3/b16-10+