(4-tert-butyl-2-methoxycarbonyl-imidazol-2-yl)methyl-triphenyl-phosphanium chloride

Systemtic Name: (4-tert-butyl-2-methoxycarbonyl-imidazol-2-yl)methyl-triphenyl-phosphanium chloride Openeye Name: (4-tert-butyl-2-methoxycarbonyl-imidazol-2-yl)methyl-triphenyl-phosphonium chloride CAS Name: (4-tert-butyl-2-methoxycarbonyl-2-imidazolyl)methyl-triphenylphosphonium chloride IUPAC Name: (4-tert-butyl-2-methoxycarbonylimidazol-2-yl)methyl-triphenylphosphanium chloride Traditional Name: (4-tert-butyl-2-carbomethoxy-imidazol-2-yl)methyl-triphenyl-phosphonium chloride Formula: C28H30ClN2O2P MolecularWeight: 492.976761

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H30N2O2P.ClH/c1-27(2,3)25-20-29-28(30-25,26(31)32-4)21-33(22-14-8-5-9-15-22,23-16-10-6-11-17-23)24-18-12-7-13-19-24;/h5-20H,21H2,1-4H3;1H/q+1;/p-1