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tributyl-(2-methyl-2-oxidanyl-4,4-diphenyl-butyl)azanium bromide

Systemtic Name:	tributyl-(2-methyl-2-oxidanyl-4,4-diphenyl-butyl)azanium bromide
Openeye Name:	tributyl-(2-hydroxy-2-methyl-4,4-diphenyl-butyl)ammonium bromide
CAS Name:	tributyl-(2-hydroxy-2-methyl-4,4-diphenylbutyl)ammonium bromide
IUPAC Name:	tributyl-(2-hydroxy-2-methyl-4,4-diphenylbutyl)azanium bromide
Traditional Name:	tributyl-(2-hydroxy-2-methyl-4,4-diphenyl-butyl)ammonium bromide
Formula:	C₂₉H₄₆BrNO
MolecularWeight:	504.58564

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[N+](CCCC)(CCCC)CC(C)(CC(C1=CC=CC=C1)C2=CC=CC=C2)O.[Br-]

Isomeric SMILES

CCCC[N+](CCCC)(CCCC)CC(C)(CC(C1=CC=CC=C1)C2=CC=CC=C2)O.[Br-]

InChI

InChI=1S/C29H46NO.BrH/c1-5-8-21-30(22-9-6-2,23-10-7-3)25-29(4,31)24-28(26-17-13-11-14-18-26)27-19-15-12-16-20-27;/h11-20,28,31H,5-10,21-25H2,1-4H3;1H/q+1;/p-1

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