5,8-dimethyl-2,2-diphenyl-1,3,4,5-tetrahydro-2-benzophosphepin-2-ium hexafluorophosphate

Systemtic Name: 5,8-dimethyl-2,2-diphenyl-1,3,4,5-tetrahydro-2-benzophosphepin-2-ium hexafluorophosphate Openeye Name: 5,8-dimethyl-2,2-diphenyl-1,3,4,5-tetrahydro-2-benzophosphepin-2-ium hexafluorophosphate CAS Name: 5,8-dimethyl-2,2-diphenyl-1,3,4,5-tetrahydro-2-benzophosphepin-2-ium hexafluorophosphate IUPAC Name: 5,8-dimethyl-2,2-diphenyl-1,3,4,5-tetrahydro-2-benzophosphepin-2-ium hexafluorophosphate Traditional Name: 5,8-dimethyl-2,2-diphenyl-1,3,4,5-tetrahydro-2-benzophosphepin-2-ium hexafluorophosphate Formula: C24H26F6P2 MolecularWeight: 490.401181

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[P+](CC2=C1C=CC(=C2)C)(C3=CC=CC=C3)C4=CC=CC=C4.F[P-](F)(F)(F)(F)F

Isomeric SMILES

CC1CC[P+](CC2=C1C=CC(=C2)C)(C3=CC=CC=C3)C4=CC=CC=C4.F[P-](F)(F)(F)(F)F

InChI

InChI=1S/C24H26P.F6P/c1-19-13-14-24-20(2)15-16-25(18-21(24)17-19,22-9-5-3-6-10-22)23-11-7-4-8-12-23;1-7(2,3,4,5)6/h3-14,17,20H,15-16,18H2,1-2H3;/q+1;-1