[5-(bromomethyl)-2,4,6-trimethyl-pyridin-3-yl]methyl-triphenyl-phosphanium bromide

Systemtic Name: [5-(bromomethyl)-2,4,6-trimethyl-pyridin-3-yl]methyl-triphenyl-phosphanium bromide Openeye Name: [5-(bromomethyl)-2,4,6-trimethyl-3-pyridyl]methyl-triphenyl-phosphonium bromide CAS Name: [5-(bromomethyl)-2,4,6-trimethyl-3-pyridinyl]methyl-triphenylphosphonium bromide IUPAC Name: [5-(bromomethyl)-2,4,6-trimethylpyridin-3-yl]methyl-triphenylphosphanium bromide Traditional Name: [5-(bromomethyl)-2,4,6-trimethyl-3-pyridyl]methyl-triphenyl-phosphonium bromide Formula: C28H28Br2NP MolecularWeight: 569.310381

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=C1CBr)C)C)C[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[Br-]

Isomeric SMILES

CC1=C(C(=NC(=C1CBr)C)C)C[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[Br-]

InChI

InChI=1S/C28H28BrNP.BrH/c1-21-27(19-29)22(2)30-23(3)28(21)20-31(24-13-7-4-8-14-24,25-15-9-5-10-16-25)26-17-11-6-12-18-26;/h4-18H,19-20H2,1-3H3;1H/q+1;/p-1