(4-cyanophenyl) 3-fluoranyl-4-[4-(octoxymethyl)cyclohexyl]benzoate

Systemtic Name: (4-cyanophenyl) 3-fluoranyl-4-[4-(octoxymethyl)cyclohexyl]benzoate Openeye Name: (4-cyanophenyl) 3-fluoro-4-[4-(octoxymethyl)cyclohexyl]benzoate CAS Name: 3-fluoro-4-[4-(octoxymethyl)cyclohexyl]benzoic acid (4-cyanophenyl) ester IUPAC Name: (4-cyanophenyl) 3-fluoro-4-[4-(octoxymethyl)cyclohexyl]benzoate Traditional Name: 3-fluoro-4-[4-(octoxymethyl)cyclohexyl]benzoic acid (4-cyanophenyl) ester Formula: C29H36FNO3 MolecularWeight: 465.599443

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOCC1CCC(CC1)C2=C(C=C(C=C2)C(=O)OC3=CC=C(C=C3)C#N)F

Isomeric SMILES

CCCCCCCCOCC1CCC(CC1)C2=C(C=C(C=C2)C(=O)OC3=CC=C(C=C3)C#N)F

InChI

InChI=1S/C29H36FNO3/c1-2-3-4-5-6-7-18-33-21-23-8-12-24(13-9-23)27-17-14-25(19-28(27)30)29(32)34-26-15-10-22(20-31)11-16-26/h10-11,14-17,19,23-24H,2-9,12-13,18,21H2,1H3