(2-butyl-4-methyl-imidazol-2-yl)methyl-triphenyl-phosphanium bromide

Systemtic Name: (2-butyl-4-methyl-imidazol-2-yl)methyl-triphenyl-phosphanium bromide Openeye Name: (2-butyl-4-methyl-imidazol-2-yl)methyl-triphenyl-phosphonium bromide CAS Name: (2-butyl-4-methyl-2-imidazolyl)methyl-triphenylphosphonium bromide IUPAC Name: (2-butyl-4-methylimidazol-2-yl)methyl-triphenylphosphanium bromide Traditional Name: (2-butyl-4-methyl-imidazol-2-yl)methyl-triphenyl-phosphonium bromide Formula: C27H30BrN2P MolecularWeight: 493.418261

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1(N=CC(=N1)C)C[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[Br-]

Isomeric SMILES

CCCCC1(N=CC(=N1)C)C[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[Br-]

InChI

InChI=1S/C27H30N2P.BrH/c1-3-4-20-27(28-21-23(2)29-27)22-30(24-14-8-5-9-15-24,25-16-10-6-11-17-25)26-18-12-7-13-19-26;/h5-19,21H,3-4,20,22H2,1-2H3;1H/q+1;/p-1