[(1R,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl]oxy-triphenyl-phosphanium tetrafluoroborate

Systemtic Name: [(1R,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl]oxy-triphenyl-phosphanium tetrafluoroborate Openeye Name: [(1R,2S,5R)-2-isopropyl-5-methyl-cyclohexoxy]-triphenyl-phosphonium tetrafluoroborate CAS Name: [(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl]oxy-triphenylphosphonium tetrafluoroborate IUPAC Name: [(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl]oxy-triphenylphosphanium tetrafluoroborate Traditional Name: [(1R,2S,5R)-2-isopropyl-5-methyl-cyclohexoxy]-triphenyl-phosphonium tetrafluoroborate Formula: C28H34BF4OP MolecularWeight: 504.347334

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Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.CC1CCC(C(C1)O[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)C(C)C

Isomeric SMILES

[B-](F)(F)(F)F.C[C@@H]1CC[C@H]([C@@H](C1)O[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)C(C)C

InChI

InChI=1S/C28H34OP.BF4/c1-22(2)27-20-19-23(3)21-28(27)29-30(24-13-7-4-8-14-24,25-15-9-5-10-16-25)26-17-11-6-12-18-26;2-1(3,4)5/h4-18,22-23,27-28H,19-21H2,1-3H3;/q+1;-1/t23-,27+,28-;/m1./s1