(4-cyanophenyl) 2,3-bis(fluoranyl)-4-[(4-hexoxycyclohexyl)methoxy]benzoate

Systemtic Name: (4-cyanophenyl) 2,3-bis(fluoranyl)-4-[(4-hexoxycyclohexyl)methoxy]benzoate Openeye Name: (4-cyanophenyl) 2,3-difluoro-4-[(4-hexoxycyclohexyl)methoxy]benzoate CAS Name: 2,3-difluoro-4-[(4-hexoxycyclohexyl)methoxy]benzoic acid (4-cyanophenyl) ester IUPAC Name: (4-cyanophenyl) 2,3-difluoro-4-[(4-hexoxycyclohexyl)methoxy]benzoate Traditional Name: 2,3-difluoro-4-[(4-hexoxycyclohexyl)methoxy]benzoic acid (4-cyanophenyl) ester Formula: C27H31F2NO4 MolecularWeight: 471.536146

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1CCC(CC1)COC2=C(C(=C(C=C2)C(=O)OC3=CC=C(C=C3)C#N)F)F

Isomeric SMILES

CCCCCCOC1CCC(CC1)COC2=C(C(=C(C=C2)C(=O)OC3=CC=C(C=C3)C#N)F)F

InChI

InChI=1S/C27H31F2NO4/c1-2-3-4-5-16-32-21-10-8-20(9-11-21)18-33-24-15-14-23(25(28)26(24)29)27(31)34-22-12-6-19(17-30)7-13-22/h6-7,12-15,20-21H,2-5,8-11,16,18H2,1H3