(4-chloranyl-3-fluoranyl-phenyl) 4-[(E)-2-(4-butoxycyclohexyl)ethenyl]cyclohexane-1-carboxylate

Systemtic Name: (4-chloranyl-3-fluoranyl-phenyl) 4-[(E)-2-(4-butoxycyclohexyl)ethenyl]cyclohexane-1-carboxylate Openeye Name: (4-chloro-3-fluoro-phenyl) 4-[(E)-2-(4-butoxycyclohexyl)vinyl]cyclohexanecarboxylate CAS Name: 4-[(E)-2-(4-butoxycyclohexyl)ethenyl]-1-cyclohexanecarboxylic acid (4-chloro-3-fluorophenyl) ester IUPAC Name: (4-chloro-3-fluorophenyl) 4-[(E)-2-(4-butoxycyclohexyl)ethenyl]cyclohexane-1-carboxylate Traditional Name: 4-[(E)-2-(4-butoxycyclohexyl)vinyl]cyclohexanecarboxylic acid (4-chloro-3-fluoro-phenyl) ester Formula: C25H34ClFO3 MolecularWeight: 436.987063

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1CCC(CC1)C=CC2CCC(CC2)C(=O)OC3=CC(=C(C=C3)Cl)F

Isomeric SMILES

CCCCOC1CCC(CC1)/C=C/C2CCC(CC2)C(=O)OC3=CC(=C(C=C3)Cl)F

InChI

InChI=1S/C25H34ClFO3/c1-2-3-16-29-21-12-8-19(9-13-21)5-4-18-6-10-20(11-7-18)25(28)30-22-14-15-23(26)24(27)17-22/h4-5,14-15,17-21H,2-3,6-13,16H2,1H3/b5-4+