2-[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]propyl-triphenyl-phosphanium iodide

Systemtic Name: 2-[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]propyl-triphenyl-phosphanium iodide Openeye Name: 2-(1-tert-butoxycarbonyl-4-piperidyl)propyl-triphenyl-phosphonium iodide CAS Name: 2-[1-[(2-methylpropan-2-yl)oxy-oxomethyl]-4-piperidinyl]propyl-triphenylphosphonium iodide IUPAC Name: 2-[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]propyl-triphenylphosphanium iodide Traditional Name: 2-(1-tert-butoxycarbonyl-4-piperidyl)propyl-triphenyl-phosphonium iodide Formula: C31H39INO2P MolecularWeight: 615.525091

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Descriptors Computed from Structure

Canonical SMILES:

CC(C[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)C4CCN(CC4)C(=O)OC(C)(C)C.[I-]

Isomeric SMILES

CC(C[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)C4CCN(CC4)C(=O)OC(C)(C)C.[I-]

InChI

InChI=1S/C31H39NO2P.HI/c1-25(26-20-22-32(23-21-26)30(33)34-31(2,3)4)24-35(27-14-8-5-9-15-27,28-16-10-6-11-17-28)29-18-12-7-13-19-29;/h5-19,25-26H,20-24H2,1-4H3;1H/q+1;/p-1