6,6-diphenyl-5,7-dihydrobenzo[d][2]benzophosphepin-6-ium bromide

Systemtic Name: 6,6-diphenyl-5,7-dihydrobenzo[d][2]benzophosphepin-6-ium bromide Openeye Name: 6,6-diphenyl-5,7-dihydrobenzo[d][2]benzophosphepin-6-ium bromide CAS Name: 6,6-diphenyl-5,7-dihydrobenzo[d][2]benzophosphepin-6-ium bromide IUPAC Name: 6,6-diphenyl-5,7-dihydrobenzo[d][2]benzophosphepin-6-ium bromide Traditional Name: 6,6-diphenyl-5,7-dihydrobenzo[d][2]benzophosphepin-6-ium bromide Formula: C26H22BrP MolecularWeight: 445.330641

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2C3=CC=CC=C3C[P+]1(C4=CC=CC=C4)C5=CC=CC=C5.[Br-]

Isomeric SMILES

C1C2=CC=CC=C2C3=CC=CC=C3C[P+]1(C4=CC=CC=C4)C5=CC=CC=C5.[Br-]

InChI

InChI=1S/C26H22P.BrH/c1-3-13-23(14-4-1)27(24-15-5-2-6-16-24)19-21-11-7-9-17-25(21)26-18-10-8-12-22(26)20-27;/h1-18H,19-20H2;1H/q+1;/p-1