methyl 2-(4-fluorophenyl)-4,6,6-trimethyl-4-oxidanyl-cyclohex-2-ene-1-carboxylate

Systemtic Name: methyl 2-(4-fluorophenyl)-4,6,6-trimethyl-4-oxidanyl-cyclohex-2-ene-1-carboxylate Openeye Name: methyl 2-(4-fluorophenyl)-4-hydroxy-4,6,6-trimethyl-cyclohex-2-ene-1-carboxylate CAS Name: 2-(4-fluorophenyl)-4-hydroxy-4,6,6-trimethyl-1-cyclohex-2-enecarboxylic acid methyl ester IUPAC Name: methyl 2-(4-fluorophenyl)-4-hydroxy-4,6,6-trimethylcyclohex-2-ene-1-carboxylate Traditional Name: 2-(4-fluorophenyl)-4-hydroxy-4,6,6-trimethyl-cyclohex-2-ene-1-carboxylic acid methyl ester Formula: C17H21FO3 MolecularWeight: 292.345243

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(C=C(C1C(=O)OC)C2=CC=C(C=C2)F)(C)O)C

Isomeric SMILES

CC1(CC(C=C(C1C(=O)OC)C2=CC=C(C=C2)F)(C)O)C

InChI

InChI=1S/C17H21FO3/c1-16(2)10-17(3,20)9-13(14(16)15(19)21-4)11-5-7-12(18)8-6-11/h5-9,14,20H,10H2,1-4H3