dimethyl 1-(3-fluorophenyl)-4-oxidanylidene-cyclohexane-1,3-dicarboxylate

Systemtic Name: dimethyl 1-(3-fluorophenyl)-4-oxidanylidene-cyclohexane-1,3-dicarboxylate Openeye Name: dimethyl 1-(3-fluorophenyl)-4-oxo-cyclohexane-1,3-dicarboxylate CAS Name: 1-(3-fluorophenyl)-4-oxocyclohexane-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 1-(3-fluorophenyl)-4-oxocyclohexane-1,3-dicarboxylate Traditional Name: 1-(3-fluorophenyl)-4-keto-cyclohexane-1,3-dicarboxylic acid dimethyl ester Formula: C16H17FO5 MolecularWeight: 308.301583

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CC(CCC1=O)(C2=CC(=CC=C2)F)C(=O)OC

Isomeric SMILES

COC(=O)C1CC(CCC1=O)(C2=CC(=CC=C2)F)C(=O)OC

InChI

InChI=1S/C16H17FO5/c1-21-14(19)12-9-16(15(20)22-2,7-6-13(12)18)10-4-3-5-11(17)8-10/h3-5,8,12H,6-7,9H2,1-2H3