1-(4-octoxyphenyl)pentan-2-yl 2,3-bis(fluoranyl)cyclohexane-1-carboxylate

Systemtic Name: 1-(4-octoxyphenyl)pentan-2-yl 2,3-bis(fluoranyl)cyclohexane-1-carboxylate Openeye Name: 1-[(4-octoxyphenyl)methyl]butyl 2,3-difluorocyclohexanecarboxylate CAS Name: 2,3-difluoro-1-cyclohexanecarboxylic acid 1-(4-octoxyphenyl)pentan-2-yl ester IUPAC Name: 1-(4-octoxyphenyl)pentan-2-yl 2,3-difluorocyclohexane-1-carboxylate Traditional Name: 2,3-difluorocyclohexanecarboxylic acid 1-(4-octoxybenzyl)butyl ester Formula: C26H40F2O3 MolecularWeight: 438.590806

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)CC(CCC)OC(=O)C2CCCC(C2F)F

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)CC(CCC)OC(=O)C2CCCC(C2F)F

InChI

InChI=1S/C26H40F2O3/c1-3-5-6-7-8-9-18-30-21-16-14-20(15-17-21)19-22(11-4-2)31-26(29)23-12-10-13-24(27)25(23)28/h14-17,22-25H,3-13,18-19H2,1-2H3