ethyl 6-[4-(diethylamino)phenyl]-4-(4-fluorophenyl)-2-oxidanylidene-cyclohex-3-ene-1-carboxylate

Systemtic Name: ethyl 6-[4-(diethylamino)phenyl]-4-(4-fluorophenyl)-2-oxidanylidene-cyclohex-3-ene-1-carboxylate Openeye Name: ethyl 6-[4-(diethylamino)phenyl]-4-(4-fluorophenyl)-2-oxo-cyclohex-3-ene-1-carboxylate CAS Name: 6-[4-(diethylamino)phenyl]-4-(4-fluorophenyl)-2-oxo-1-cyclohex-3-enecarboxylic acid ethyl ester IUPAC Name: ethyl 6-[4-(diethylamino)phenyl]-4-(4-fluorophenyl)-2-oxocyclohex-3-ene-1-carboxylate Traditional Name: 6-[4-(diethylamino)phenyl]-4-(4-fluorophenyl)-2-keto-cyclohex-3-ene-1-carboxylic acid ethyl ester Formula: C25H28FNO3 MolecularWeight: 409.493123

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H28FNO3/c1-4-27(5-2)21-13-9-18(10-14-21)22-15-19(17-7-11-20(26)12-8-17)16-23(28)24(22)25(29)30-6-3/h7-14,16,22,24H,4-6,15H2,1-3H3