[4-(tert-butylcarbamoyl)phenyl]methyl-triphenyl-phosphanium bromide

Systemtic Name: [4-(tert-butylcarbamoyl)phenyl]methyl-triphenyl-phosphanium bromide Openeye Name: [4-(tert-butylcarbamoyl)phenyl]methyl-triphenyl-phosphonium bromide CAS Name: [4-[(tert-butylamino)-oxomethyl]phenyl]methyl-triphenylphosphonium bromide IUPAC Name: [4-(tert-butylcarbamoyl)phenyl]methyl-triphenylphosphanium bromide Traditional Name: [4-(tert-butylcarbamoyl)benzyl]-triphenyl-phosphonium bromide Formula: C30H31BrNOP MolecularWeight: 532.451001

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)C1=CC=C(C=C1)C[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[Br-]

Isomeric SMILES

CC(C)(C)NC(=O)C1=CC=C(C=C1)C[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[Br-]

InChI

InChI=1S/C30H30NOP.BrH/c1-30(2,3)31-29(32)25-21-19-24(20-22-25)23-33(26-13-7-4-8-14-26,27-15-9-5-10-16-27)28-17-11-6-12-18-28;/h4-22H,23H2,1-3H3;1H