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pentan-2-yl 1-[2,3-bis(fluoranyl)-4-octoxy-phenyl]cyclohexane-1-carboxylate

pentan-2-yl 1-[2,3-bis(fluoranyl)-4-octoxy-phenyl]cyclohexane-1-carboxylate

Systemtic Name:pentan-2-yl 1-[2,3-bis(fluoranyl)-4-octoxy-phenyl]cyclohexane-1-carboxylate
Openeye Name:1-methylbutyl 1-(2,3-difluoro-4-octoxy-phenyl)cyclohexanecarboxylate
CAS Name:1-(2,3-difluoro-4-octoxyphenyl)-1-cyclohexanecarboxylic acid pentan-2-yl ester
IUPAC Name:pentan-2-yl 1-(2,3-difluoro-4-octoxyphenyl)cyclohexane-1-carboxylate
Traditional Name:1-(2,3-difluoro-4-octoxy-phenyl)cyclohexanecarboxylic acid 1-methylbutyl ester
Formula: C26H40F2O3
MolecularWeight: 438.590806
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=C(C(=C(C=C1)C2(CCCCC2)C(=O)OC(C)CCC)F)F


Isomeric SMILES

CCCCCCCCOC1=C(C(=C(C=C1)C2(CCCCC2)C(=O)OC(C)CCC)F)F


InChI

InChI=1S/C26H40F2O3/c1-4-6-7-8-9-13-19-30-22-16-15-21(23(27)24(22)28)26(17-11-10-12-18-26)25(29)31-20(3)14-5-2/h15-16,20H,4-14,17-19H2,1-3H3


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