(2-chloranyl-4-fluoranyl-phenyl) 4-[4-(4-pentylcyclohexyl)phenyl]benzoate

Systemtic Name: (2-chloranyl-4-fluoranyl-phenyl) 4-[4-(4-pentylcyclohexyl)phenyl]benzoate Openeye Name: (2-chloro-4-fluoro-phenyl) 4-[4-(4-pentylcyclohexyl)phenyl]benzoate CAS Name: 4-[4-(4-pentylcyclohexyl)phenyl]benzoic acid (2-chloro-4-fluorophenyl) ester IUPAC Name: (2-chloro-4-fluorophenyl) 4-[4-(4-pentylcyclohexyl)phenyl]benzoate Traditional Name: 4-[4-(4-amylcyclohexyl)phenyl]benzoic acid (2-chloro-4-fluoro-phenyl) ester Formula: C30H32ClFO2 MolecularWeight: 479.025283

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CCC(CC1)C2=CC=C(C=C2)C3=CC=C(C=C3)C(=O)OC4=C(C=C(C=C4)F)Cl

Isomeric SMILES

CCCCCC1CCC(CC1)C2=CC=C(C=C2)C3=CC=C(C=C3)C(=O)OC4=C(C=C(C=C4)F)Cl

InChI

InChI=1S/C30H32ClFO2/c1-2-3-4-5-21-6-8-22(9-7-21)23-10-12-24(13-11-23)25-14-16-26(17-15-25)30(33)34-29-19-18-27(32)20-28(29)31/h10-22H,2-9H2,1H3