[4-[4-(4-bromanyl-3-fluoranyl-phenyl)cyclohexyl]cyclohexyl] pent-4-enoate

Systemtic Name: [4-[4-(4-bromanyl-3-fluoranyl-phenyl)cyclohexyl]cyclohexyl] pent-4-enoate Openeye Name: [4-[4-(4-bromo-3-fluoro-phenyl)cyclohexyl]cyclohexyl] pent-4-enoate CAS Name: 4-pentenoic acid [4-[4-(4-bromo-3-fluorophenyl)cyclohexyl]cyclohexyl] ester IUPAC Name: [4-[4-(4-bromo-3-fluorophenyl)cyclohexyl]cyclohexyl] pent-4-enoate Traditional Name: pent-4-enoic acid [4-[4-(4-bromo-3-fluoro-phenyl)cyclohexyl]cyclohexyl] ester Formula: C23H30BrFO2 MolecularWeight: 437.385503

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Descriptors Computed from Structure

Canonical SMILES:

C=CCCC(=O)OC1CCC(CC1)C2CCC(CC2)C3=CC(=C(C=C3)Br)F

Isomeric SMILES

C=CCCC(=O)OC1CCC(CC1)C2CCC(CC2)C3=CC(=C(C=C3)Br)F

InChI

InChI=1S/C23H30BrFO2/c1-2-3-4-23(26)27-20-12-9-17(10-13-20)16-5-7-18(8-6-16)19-11-14-21(24)22(25)15-19/h2,11,14-18,20H,1,3-10,12-13H2