(3-chloranyl-4-fluoranyl-phenyl) 4-[4-(4-propylcyclohexyl)cyclohexyl]benzoate

Systemtic Name: (3-chloranyl-4-fluoranyl-phenyl) 4-[4-(4-propylcyclohexyl)cyclohexyl]benzoate Openeye Name: (3-chloro-4-fluoro-phenyl) 4-[4-(4-propylcyclohexyl)cyclohexyl]benzoate CAS Name: 4-[4-(4-propylcyclohexyl)cyclohexyl]benzoic acid (3-chloro-4-fluorophenyl) ester IUPAC Name: (3-chloro-4-fluorophenyl) 4-[4-(4-propylcyclohexyl)cyclohexyl]benzoate Traditional Name: 4-[4-(4-propylcyclohexyl)cyclohexyl]benzoic acid (3-chloro-4-fluoro-phenyl) ester Formula: C28H34ClFO2 MolecularWeight: 457.019763

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1CCC(CC1)C2CCC(CC2)C3=CC=C(C=C3)C(=O)OC4=CC(=C(C=C4)F)Cl

Isomeric SMILES

CCCC1CCC(CC1)C2CCC(CC2)C3=CC=C(C=C3)C(=O)OC4=CC(=C(C=C4)F)Cl

InChI

InChI=1S/C28H34ClFO2/c1-2-3-19-4-6-20(7-5-19)21-8-10-22(11-9-21)23-12-14-24(15-13-23)28(31)32-25-16-17-27(30)26(29)18-25/h12-22H,2-11H2,1H3