1-(2-ethyl-4,6-dimethyl-heptyl)imidazole; (4-ethylsulfanylphenyl)-phenyl-[(E)-5,5,5-tris(fluoranyl)pent-3-enyl]borane

Systemtic Name: 1-(2-ethyl-4,6-dimethyl-heptyl)imidazole; (4-ethylsulfanylphenyl)-phenyl-[(E)-5,5,5-tris(fluoranyl)pent-3-enyl]borane Openeye Name: 1-(2-ethyl-4,6-dimethyl-heptyl)imidazole; (4-ethylsulfanylphenyl)-phenyl-[(E)-5,5,5-trifluoropent-3-enyl]borane CAS Name: 1-(2-ethyl-4,6-dimethylheptyl)imidazole; [4-(ethylthio)phenyl]-phenyl-[(E)-5,5,5-trifluoropent-3-enyl]borane IUPAC Name: 1-(2-ethyl-4,6-dimethylheptyl)imidazole; (4-ethylsulfanylphenyl)-phenyl-[(E)-5,5,5-trifluoropent-3-enyl]borane Traditional Name: 1-(2-ethyl-4,6-dimethyl-heptyl)imidazole; [4-(ethylthio)phenyl]-phenyl-[(E)-5,5,5-trifluoropent-3-enyl]borane Formula: C33H46BF3N2S MolecularWeight: 570.60295

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Descriptors Computed from Structure

Canonical SMILES:

B(CCC=CC(F)(F)F)(C1=CC=CC=C1)C2=CC=C(C=C2)SCC.CCC(CC(C)CC(C)C)CN1C=CN=C1

Isomeric SMILES

B(CC/C=C/C(F)(F)F)(C1=CC=CC=C1)C2=CC=C(C=C2)SCC.CCC(CC(C)CC(C)C)CN1C=CN=C1

InChI

InChI=1S/C19H20BF3S.C14H26N2/c1-2-24-18-12-10-17(11-13-18)20(16-8-4-3-5-9-16)15-7-6-14-19(21,22)23;1-5-14(9-13(4)8-12(2)3)10-16-7-6-15-11-16/h3-6,8-14H,2,7,15H2,1H3;6-7,11-14H,5,8-10H2,1-4H3/b14-6+;