2-[1-[(2-methylpropan-2-yl)oxycarbonyl]indol-3-yl]ethyl-triphenyl-phosphanium bromide

Systemtic Name: 2-[1-[(2-methylpropan-2-yl)oxycarbonyl]indol-3-yl]ethyl-triphenyl-phosphanium bromide Openeye Name: 2-(1-tert-butoxycarbonylindol-3-yl)ethyl-triphenyl-phosphonium bromide CAS Name: 2-[1-[(2-methylpropan-2-yl)oxy-oxomethyl]-3-indolyl]ethyl-triphenylphosphonium bromide IUPAC Name: 2-[1-[(2-methylpropan-2-yl)oxycarbonyl]indol-3-yl]ethyl-triphenylphosphanium bromide Traditional Name: 2-(1-tert-butoxycarbonylindol-3-yl)ethyl-triphenyl-phosphonium bromide Formula: C33H33BrNO2P MolecularWeight: 586.498381

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C=C(C2=CC=CC=C21)CC[P+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5.[Br-]

Isomeric SMILES

CC(C)(C)OC(=O)N1C=C(C2=CC=CC=C21)CC[P+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5.[Br-]

InChI

InChI=1S/C33H33NO2P.BrH/c1-33(2,3)36-32(35)34-25-26(30-21-13-14-22-31(30)34)23-24-37(27-15-7-4-8-16-27,28-17-9-5-10-18-28)29-19-11-6-12-20-29;/h4-22,25H,23-24H2,1-3H3;1H/q+1;/p-1