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

Systemtic Name: (4-pentylcyclohexyl) 4-[2-fluoranyl-4-(4-propylcyclohexyl)phenyl]benzoate Openeye Name: (4-pentylcyclohexyl) 4-[2-fluoro-4-(4-propylcyclohexyl)phenyl]benzoate CAS Name: 4-[2-fluoro-4-(4-propylcyclohexyl)phenyl]benzoic acid (4-pentylcyclohexyl) ester IUPAC Name: (4-pentylcyclohexyl) 4-[2-fluoro-4-(4-propylcyclohexyl)phenyl]benzoate Traditional Name: 4-[2-fluoro-4-(4-propylcyclohexyl)phenyl]benzoic acid (4-amylcyclohexyl) ester Formula: C33H45FO2 MolecularWeight: 492.707603

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CCC(CC1)OC(=O)C2=CC=C(C=C2)C3=C(C=C(C=C3)C4CCC(CC4)CCC)F

Isomeric SMILES

CCCCCC1CCC(CC1)OC(=O)C2=CC=C(C=C2)C3=C(C=C(C=C3)C4CCC(CC4)CCC)F

InChI

InChI=1S/C33H45FO2/c1-3-5-6-8-25-11-20-30(21-12-25)36-33(35)28-17-15-27(16-18-28)31-22-19-29(23-32(31)34)26-13-9-24(7-4-2)10-14-26/h15-19,22-26,30H,3-14,20-21H2,1-2H3