4-tert-butyl-1,1-diphenyl-phosphinan-1-ium bromide

Systemtic Name: 4-tert-butyl-1,1-diphenyl-phosphinan-1-ium bromide Openeye Name: 4-tert-butyl-1,1-diphenyl-phosphinan-1-ium bromide CAS Name: 4-tert-butyl-1,1-diphenylphosphorinan-1-ium bromide IUPAC Name: 4-tert-butyl-1,1-diphenylphosphinan-1-ium bromide Traditional Name: 4-tert-butyl-1,1-diphenyl-phosphorinan-1-ium bromide Formula: C21H28BrP MolecularWeight: 391.324781

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CC[P+](CC1)(C2=CC=CC=C2)C3=CC=CC=C3.[Br-]

Isomeric SMILES

CC(C)(C)C1CC[P+](CC1)(C2=CC=CC=C2)C3=CC=CC=C3.[Br-]

InChI

InChI=1S/C21H28P.BrH/c1-21(2,3)18-14-16-22(17-15-18,19-10-6-4-7-11-19)20-12-8-5-9-13-20;/h4-13,18H,14-17H2,1-3H3;1H/q+1;/p-1