[4-cyano-2,3-bis(fluoranyl)phenyl] 4-(4-ethylcyclohexyl)cyclohexane-1-carboxylate

Systemtic Name: [4-cyano-2,3-bis(fluoranyl)phenyl] 4-(4-ethylcyclohexyl)cyclohexane-1-carboxylate Openeye Name: (4-cyano-2,3-difluoro-phenyl) 4-(4-ethylcyclohexyl)cyclohexanecarboxylate CAS Name: 4-(4-ethylcyclohexyl)-1-cyclohexanecarboxylic acid (4-cyano-2,3-difluorophenyl) ester IUPAC Name: (4-cyano-2,3-difluorophenyl) 4-(4-ethylcyclohexyl)cyclohexane-1-carboxylate Traditional Name: 4-(4-ethylcyclohexyl)cyclohexanecarboxylic acid (4-cyano-2,3-difluoro-phenyl) ester Formula: C22H27F2NO2 MolecularWeight: 375.452086

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCC(CC1)C2CCC(CC2)C(=O)OC3=C(C(=C(C=C3)C#N)F)F

Isomeric SMILES

CCC1CCC(CC1)C2CCC(CC2)C(=O)OC3=C(C(=C(C=C3)C#N)F)F

InChI

InChI=1S/C22H27F2NO2/c1-2-14-3-5-15(6-4-14)16-7-9-17(10-8-16)22(26)27-19-12-11-18(13-25)20(23)21(19)24/h11-12,14-17H,2-10H2,1H3