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

Systemtic Name: [2,3-bis(fluoranyl)-4-propoxy-phenyl] 4-(1-pentan-2-ylcyclohexyl)cyclohexane-1-carboxylate Openeye Name: (2,3-difluoro-4-propoxy-phenyl) 4-[1-(1-methylbutyl)cyclohexyl]cyclohexanecarboxylate CAS Name: 4-(1-pentan-2-ylcyclohexyl)-1-cyclohexanecarboxylic acid (2,3-difluoro-4-propoxyphenyl) ester IUPAC Name: (2,3-difluoro-4-propoxyphenyl) 4-(1-pentan-2-ylcyclohexyl)cyclohexane-1-carboxylate Traditional Name: 4-[1-(1-methylbutyl)cyclohexyl]cyclohexanecarboxylic acid (2,3-difluoro-4-propoxy-phenyl) ester Formula: C27H40F2O3 MolecularWeight: 450.601506

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)C1(CCCCC1)C2CCC(CC2)C(=O)OC3=C(C(=C(C=C3)OCCC)F)F

Isomeric SMILES

CCCC(C)C1(CCCCC1)C2CCC(CC2)C(=O)OC3=C(C(=C(C=C3)OCCC)F)F

InChI

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