[4-cyano-2,3-bis(fluoranyl)phenyl] 4-(1-hexoxycyclohexyl)benzoate

Systemtic Name: [4-cyano-2,3-bis(fluoranyl)phenyl] 4-(1-hexoxycyclohexyl)benzoate Openeye Name: (4-cyano-2,3-difluoro-phenyl) 4-(1-hexoxycyclohexyl)benzoate CAS Name: 4-(1-hexoxycyclohexyl)benzoic acid (4-cyano-2,3-difluorophenyl) ester IUPAC Name: (4-cyano-2,3-difluorophenyl) 4-(1-hexoxycyclohexyl)benzoate Traditional Name: 4-(1-hexoxycyclohexyl)benzoic acid (4-cyano-2,3-difluoro-phenyl) ester Formula: C26H29F2NO3 MolecularWeight: 441.510166

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1(CCCCC1)C2=CC=C(C=C2)C(=O)OC3=C(C(=C(C=C3)C#N)F)F

Isomeric SMILES

CCCCCCOC1(CCCCC1)C2=CC=C(C=C2)C(=O)OC3=C(C(=C(C=C3)C#N)F)F

InChI

InChI=1S/C26H29F2NO3/c1-2-3-4-8-17-31-26(15-6-5-7-16-26)21-12-9-19(10-13-21)25(30)32-22-14-11-20(18-29)23(27)24(22)28/h9-14H,2-8,15-17H2,1H3