[1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrol-2-yl]methyl-triphenyl-phosphanium iodide

Systemtic Name: [1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrol-2-yl]methyl-triphenyl-phosphanium iodide Openeye Name: (1-tert-butoxycarbonylpyrrol-2-yl)methyl-triphenyl-phosphonium iodide CAS Name: [1-[(2-methylpropan-2-yl)oxy-oxomethyl]-2-pyrrolyl]methyl-triphenylphosphonium iodide IUPAC Name: [1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrol-2-yl]methyl-triphenylphosphanium iodide Traditional Name: (1-tert-butoxycarbonylpyrrol-2-yl)methyl-triphenyl-phosphonium iodide Formula: C28H29INO2P MolecularWeight: 569.413591

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C=CC=C1C[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[I-]

Isomeric SMILES

CC(C)(C)OC(=O)N1C=CC=C1C[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[I-]

InChI

InChI=1S/C28H29NO2P.HI/c1-28(2,3)31-27(30)29-21-13-14-23(29)22-32(24-15-7-4-8-16-24,25-17-9-5-10-18-25)26-19-11-6-12-20-26;/h4-21H,22H2,1-3H3;1H/q+1;/p-1