[4-(1-butylcyclohexyl)carbonyloxy-2,3-bis(fluoranyl)phenyl] 1-butylcyclohexane-1-carboxylate

Systemtic Name: [4-(1-butylcyclohexyl)carbonyloxy-2,3-bis(fluoranyl)phenyl] 1-butylcyclohexane-1-carboxylate Openeye Name: [4-(1-butylcyclohexanecarbonyl)oxy-2,3-difluoro-phenyl] 1-butylcyclohexanecarboxylate CAS Name: 1-butyl-1-cyclohexanecarboxylic acid [4-[(1-butylcyclohexyl)-oxomethoxy]-2,3-difluorophenyl] ester IUPAC Name: [4-(1-butylcyclohexanecarbonyl)oxy-2,3-difluorophenyl] 1-butylcyclohexane-1-carboxylate Traditional Name: 1-butylcyclohexanecarboxylic acid [4-(1-butylcyclohexanecarbonyl)oxy-2,3-difluoro-phenyl] ester Formula: C28H40F2O4 MolecularWeight: 478.611606

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1(CCCCC1)C(=O)OC2=C(C(=C(C=C2)OC(=O)C3(CCCCC3)CCCC)F)F

Isomeric SMILES

CCCCC1(CCCCC1)C(=O)OC2=C(C(=C(C=C2)OC(=O)C3(CCCCC3)CCCC)F)F

InChI

InChI=1S/C28H40F2O4/c1-3-5-15-27(17-9-7-10-18-27)25(31)33-21-13-14-22(24(30)23(21)29)34-26(32)28(16-6-4-2)19-11-8-12-20-28/h13-14H,3-12,15-20H2,1-2H3