ethyl 4-(1-ethanoyl-3-fluoranyl-4-phenyl-cyclohexa-2,5-dien-1-yl)-3-oxidanylidene-pentanoate

Systemtic Name: ethyl 4-(1-ethanoyl-3-fluoranyl-4-phenyl-cyclohexa-2,5-dien-1-yl)-3-oxidanylidene-pentanoate Openeye Name: ethyl 4-(1-acetyl-3-fluoro-4-phenyl-cyclohexa-2,5-dien-1-yl)-3-oxo-pentanoate CAS Name: 4-(1-acetyl-3-fluoro-4-phenyl-1-cyclohexa-2,5-dienyl)-3-oxopentanoic acid ethyl ester IUPAC Name: ethyl 4-(1-acetyl-3-fluoro-4-phenylcyclohexa-2,5-dien-1-yl)-3-oxopentanoate Traditional Name: 4-(1-acetyl-3-fluoro-4-phenyl-cyclohexa-2,5-dien-1-yl)-3-keto-valeric acid ethyl ester Formula: C21H23FO4 MolecularWeight: 358.403323

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23FO4/c1-4-26-20(25)12-19(24)14(2)21(15(3)23)11-10-17(18(22)13-21)16-8-6-5-7-9-16/h5-11,13-14,17H,4,12H2,1-3H3