[4-butyl-2,3-bis(fluoranyl)phenyl] 4-(4-propylcyclohexyl)cyclohexane-1-carboxylate

Systemtic Name: [4-butyl-2,3-bis(fluoranyl)phenyl] 4-(4-propylcyclohexyl)cyclohexane-1-carboxylate Openeye Name: (4-butyl-2,3-difluoro-phenyl) 4-(4-propylcyclohexyl)cyclohexanecarboxylate CAS Name: 4-(4-propylcyclohexyl)-1-cyclohexanecarboxylic acid (4-butyl-2,3-difluorophenyl) ester IUPAC Name: (4-butyl-2,3-difluorophenyl) 4-(4-propylcyclohexyl)cyclohexane-1-carboxylate Traditional Name: 4-(4-propylcyclohexyl)cyclohexanecarboxylic acid (4-butyl-2,3-difluoro-phenyl) ester Formula: C26H38F2O2 MolecularWeight: 420.575526

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C(=C(C=C1)OC(=O)C2CCC(CC2)C3CCC(CC3)CCC)F)F

Isomeric SMILES

CCCCC1=C(C(=C(C=C1)OC(=O)C2CCC(CC2)C3CCC(CC3)CCC)F)F

InChI

InChI=1S/C26H38F2O2/c1-3-5-7-21-16-17-23(25(28)24(21)27)30-26(29)22-14-12-20(13-15-22)19-10-8-18(6-4-2)9-11-19/h16-20,22H,3-15H2,1-2H3