[4-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]phenyl]methyl-triphenyl-phosphanium bromide

Systemtic Name: [4-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]phenyl]methyl-triphenyl-phosphanium bromide Openeye Name: [4-[(tert-butoxycarbonylamino)methyl]phenyl]methyl-triphenyl-phosphonium bromide CAS Name: [4-[[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]methyl]phenyl]methyl-triphenylphosphonium bromide IUPAC Name: [4-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]phenyl]methyl-triphenylphosphanium bromide Traditional Name: [4-[(tert-butoxycarbonylamino)methyl]benzyl]-triphenyl-phosphonium bromide Formula: C31H33BrNO2P MolecularWeight: 562.476981

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCC1=CC=C(C=C1)C[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[Br-]

Isomeric SMILES

CC(C)(C)OC(=O)NCC1=CC=C(C=C1)C[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[Br-]

InChI

InChI=1S/C31H32NO2P.BrH/c1-31(2,3)34-30(33)32-23-25-19-21-26(22-20-25)24-35(27-13-7-4-8-14-27,28-15-9-5-10-16-28)29-17-11-6-12-18-29;/h4-22H,23-24H2,1-3H3;1H