methyl (1R,5R)-2-(2-bromophenyl)-5-fluoranyl-cyclohexane-1-carboxylate

Systemtic Name: methyl (1R,5R)-2-(2-bromophenyl)-5-fluoranyl-cyclohexane-1-carboxylate Openeye Name: methyl (1R,5R)-2-(2-bromophenyl)-5-fluoro-cyclohexanecarboxylate CAS Name: (1R,5R)-2-(2-bromophenyl)-5-fluoro-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl (1R,5R)-2-(2-bromophenyl)-5-fluorocyclohexane-1-carboxylate Traditional Name: (1R,5R)-2-(2-bromophenyl)-5-fluoro-cyclohexanecarboxylic acid methyl ester Formula: C14H16BrFO2 MolecularWeight: 315.178043

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CC(CCC1C2=CC=CC=C2Br)F

Isomeric SMILES

COC(=O)[C@@H]1C[C@@H](CCC1C2=CC=CC=C2Br)F

InChI

InChI=1S/C14H16BrFO2/c1-18-14(17)12-8-9(16)6-7-10(12)11-4-2-3-5-13(11)15/h2-5,9-10,12H,6-8H2,1H3/t9-,10?,12-/m1/s1