[4-butoxy-2,3-bis(fluoranyl)phenyl] 4-(1-butylcyclohexyl)cyclohexane-1-carboxylate

Systemtic Name: [4-butoxy-2,3-bis(fluoranyl)phenyl] 4-(1-butylcyclohexyl)cyclohexane-1-carboxylate Openeye Name: (4-butoxy-2,3-difluoro-phenyl) 4-(1-butylcyclohexyl)cyclohexanecarboxylate CAS Name: 4-(1-butylcyclohexyl)-1-cyclohexanecarboxylic acid (4-butoxy-2,3-difluorophenyl) ester IUPAC Name: (4-butoxy-2,3-difluorophenyl) 4-(1-butylcyclohexyl)cyclohexane-1-carboxylate Traditional Name: 4-(1-butylcyclohexyl)cyclohexanecarboxylic acid (4-butoxy-2,3-difluoro-phenyl) ester Formula: C27H40F2O3 MolecularWeight: 450.601506

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1(CCCCC1)C2CCC(CC2)C(=O)OC3=C(C(=C(C=C3)OCCCC)F)F

Isomeric SMILES

CCCCC1(CCCCC1)C2CCC(CC2)C(=O)OC3=C(C(=C(C=C3)OCCCC)F)F

InChI

InChI=1S/C27H40F2O3/c1-3-5-16-27(17-8-7-9-18-27)21-12-10-20(11-13-21)26(30)32-23-15-14-22(24(28)25(23)29)31-19-6-4-2/h14-15,20-21H,3-13,16-19H2,1-2H3