ethyl 6-(4-ethoxyphenyl)-4-(4-fluorophenyl)-2-oxidanylidene-cyclohex-3-ene-1-carboxylate

Systemtic Name: ethyl 6-(4-ethoxyphenyl)-4-(4-fluorophenyl)-2-oxidanylidene-cyclohex-3-ene-1-carboxylate Openeye Name: ethyl 6-(4-ethoxyphenyl)-4-(4-fluorophenyl)-2-oxo-cyclohex-3-ene-1-carboxylate CAS Name: 6-(4-ethoxyphenyl)-4-(4-fluorophenyl)-2-oxo-1-cyclohex-3-enecarboxylic acid ethyl ester IUPAC Name: ethyl 6-(4-ethoxyphenyl)-4-(4-fluorophenyl)-2-oxocyclohex-3-ene-1-carboxylate Traditional Name: 4-(4-fluorophenyl)-2-keto-6-p-phenetyl-cyclohex-3-ene-1-carboxylic acid ethyl ester Formula: C23H23FO4 MolecularWeight: 382.424723

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2CC(=CC(=O)C2C(=O)OCC)C3=CC=C(C=C3)F

Isomeric SMILES

CCOC1=CC=C(C=C1)C2CC(=CC(=O)C2C(=O)OCC)C3=CC=C(C=C3)F

InChI

InChI=1S/C23H23FO4/c1-3-27-19-11-7-16(8-12-19)20-13-17(15-5-9-18(24)10-6-15)14-21(25)22(20)23(26)28-4-2/h5-12,14,20,22H,3-4,13H2,1-2H3