ethyl (6E)-8-cyano-9,9-bis(4-fluorophenyl)-5-oxidanyl-3-oxidanylidene-nona-6,8-dienoate

Systemtic Name: ethyl (6E)-8-cyano-9,9-bis(4-fluorophenyl)-5-oxidanyl-3-oxidanylidene-nona-6,8-dienoate Openeye Name: ethyl (6E)-8-cyano-9,9-bis(4-fluorophenyl)-5-hydroxy-3-oxo-nona-6,8-dienoate CAS Name: (6E)-8-cyano-9,9-bis(4-fluorophenyl)-5-hydroxy-3-oxonona-6,8-dienoic acid ethyl ester IUPAC Name: ethyl (6E)-8-cyano-9,9-bis(4-fluorophenyl)-5-hydroxy-3-oxonona-6,8-dienoate Traditional Name: (6E)-8-cyano-9,9-bis(4-fluorophenyl)-5-hydroxy-3-keto-nona-6,8-dienoic acid ethyl ester Formula: C24H21F2NO4 MolecularWeight: 425.424646

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(=O)CC(C=CC(=C(C1=CC=C(C=C1)F)C2=CC=C(C=C2)F)C#N)O

Isomeric SMILES

CCOC(=O)CC(=O)CC(/C=C/C(=C(C1=CC=C(C=C1)F)C2=CC=C(C=C2)F)C#N)O

InChI

InChI=1S/C24H21F2NO4/c1-2-31-23(30)14-22(29)13-21(28)12-7-18(15-27)24(16-3-8-19(25)9-4-16)17-5-10-20(26)11-6-17/h3-12,21,28H,2,13-14H2,1H3/b12-7+