(4-octoxycyclohexyl) 4-(4-fluorophenyl)benzoate

Systemtic Name: (4-octoxycyclohexyl) 4-(4-fluorophenyl)benzoate Openeye Name: (4-octoxycyclohexyl) 4-(4-fluorophenyl)benzoate CAS Name: 4-(4-fluorophenyl)benzoic acid (4-octoxycyclohexyl) ester IUPAC Name: (4-octoxycyclohexyl) 4-(4-fluorophenyl)benzoate Traditional Name: 4-(4-fluorophenyl)benzoic acid (4-octoxycyclohexyl) ester Formula: C27H35FO3 MolecularWeight: 426.563403

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1CCC(CC1)OC(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)F

Isomeric SMILES

CCCCCCCCOC1CCC(CC1)OC(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)F

InChI

InChI=1S/C27H35FO3/c1-2-3-4-5-6-7-20-30-25-16-18-26(19-17-25)31-27(29)23-10-8-21(9-11-23)22-12-14-24(28)15-13-22/h8-15,25-26H,2-7,16-20H2,1H3