ethyl 6-(2-chloranyl-6-fluoranyl-phenyl)-2-oxidanylidene-4-phenyl-cyclohex-3-ene-1-carboxylate

Systemtic Name: ethyl 6-(2-chloranyl-6-fluoranyl-phenyl)-2-oxidanylidene-4-phenyl-cyclohex-3-ene-1-carboxylate Openeye Name: ethyl 6-(2-chloro-6-fluoro-phenyl)-2-oxo-4-phenyl-cyclohex-3-ene-1-carboxylate CAS Name: 6-(2-chloro-6-fluorophenyl)-2-oxo-4-phenyl-1-cyclohex-3-enecarboxylic acid ethyl ester IUPAC Name: ethyl 6-(2-chloro-6-fluorophenyl)-2-oxo-4-phenylcyclohex-3-ene-1-carboxylate Traditional Name: 6-(2-chloro-6-fluoro-phenyl)-2-keto-4-phenyl-cyclohex-3-ene-1-carboxylic acid ethyl ester Formula: C21H18ClFO3 MolecularWeight: 372.817223

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(CC(=CC1=O)C2=CC=CC=C2)C3=C(C=CC=C3Cl)F

Isomeric SMILES

CCOC(=O)C1C(CC(=CC1=O)C2=CC=CC=C2)C3=C(C=CC=C3Cl)F

InChI

InChI=1S/C21H18ClFO3/c1-2-26-21(25)20-15(19-16(22)9-6-10-17(19)23)11-14(12-18(20)24)13-7-4-3-5-8-13/h3-10,12,15,20H,2,11H2,1H3