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

Systemtic Name: [4-cyano-2,3-bis(fluoranyl)phenyl] 4-heptylcyclohexane-1-carboxylate Openeye Name: (4-cyano-2,3-difluoro-phenyl) 4-heptylcyclohexanecarboxylate CAS Name: 4-heptyl-1-cyclohexanecarboxylic acid (4-cyano-2,3-difluorophenyl) ester IUPAC Name: (4-cyano-2,3-difluorophenyl) 4-heptylcyclohexane-1-carboxylate Traditional Name: 4-heptylcyclohexanecarboxylic acid (4-cyano-2,3-difluoro-phenyl) ester Formula: C21H27F2NO2 MolecularWeight: 363.441386

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1CCC(CC1)C(=O)OC2=C(C(=C(C=C2)C#N)F)F

Isomeric SMILES

CCCCCCCC1CCC(CC1)C(=O)OC2=C(C(=C(C=C2)C#N)F)F

InChI

InChI=1S/C21H27F2NO2/c1-2-3-4-5-6-7-15-8-10-16(11-9-15)21(25)26-18-13-12-17(14-24)19(22)20(18)23/h12-13,15-16H,2-11H2,1H3