(4-cyano-3-fluoranyl-phenyl) 4-[2-(4-butylcyclohexyl)ethyl]-2-fluoranyl-benzoate

Systemtic Name: (4-cyano-3-fluoranyl-phenyl) 4-[2-(4-butylcyclohexyl)ethyl]-2-fluoranyl-benzoate Openeye Name: (4-cyano-3-fluoro-phenyl) 4-[2-(4-butylcyclohexyl)ethyl]-2-fluoro-benzoate CAS Name: 4-[2-(4-butylcyclohexyl)ethyl]-2-fluorobenzoic acid (4-cyano-3-fluorophenyl) ester IUPAC Name: (4-cyano-3-fluorophenyl) 4-[2-(4-butylcyclohexyl)ethyl]-2-fluorobenzoate Traditional Name: 4-[2-(4-butylcyclohexyl)ethyl]-2-fluoro-benzoic acid (4-cyano-3-fluoro-phenyl) ester Formula: C26H29F2NO2 MolecularWeight: 425.510766

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CCC(CC1)CCC2=CC(=C(C=C2)C(=O)OC3=CC(=C(C=C3)C#N)F)F

Isomeric SMILES

CCCCC1CCC(CC1)CCC2=CC(=C(C=C2)C(=O)OC3=CC(=C(C=C3)C#N)F)F

InChI

InChI=1S/C26H29F2NO2/c1-2-3-4-18-5-7-19(8-6-18)9-10-20-11-14-23(25(28)15-20)26(30)31-22-13-12-21(17-29)24(27)16-22/h11-16,18-19H,2-10H2,1H3