triphenyl-[(2,2,5,5-tetramethyl-1-oxidanidyl-1H-pyrrol-1-ium-3-yl)methyl]phosphanium bromide

Systemtic Name: triphenyl-[(2,2,5,5-tetramethyl-1-oxidanidyl-1H-pyrrol-1-ium-3-yl)methyl]phosphanium bromide Openeye Name: triphenyl-[(2,2,5,5-tetramethyl-1-oxido-1H-pyrrol-1-ium-3-yl)methyl]phosphonium bromide CAS Name: triphenyl-[(2,2,5,5-tetramethyl-1-oxido-1H-pyrrol-1-ium-3-yl)methyl]phosphonium bromide IUPAC Name: triphenyl-[(2,2,5,5-tetramethyl-1-oxido-1H-pyrrol-1-ium-3-yl)methyl]phosphanium bromide Traditional Name: triphenyl-[(2,2,5,5-tetramethyl-1-oxido-3-pyrrolin-1-ium-3-yl)methyl]phosphonium bromide Formula: C27H31BrNOP MolecularWeight: 496.418901

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C=C(C([NH+]1[O-])(C)C)C[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)C.[Br-]

Isomeric SMILES

CC1(C=C(C([NH+]1[O-])(C)C)C[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)C.[Br-]

InChI

InChI=1S/C27H31NOP.BrH/c1-26(2)20-22(27(3,4)28(26)29)21-30(23-14-8-5-9-15-23,24-16-10-6-11-17-24)25-18-12-7-13-19-25;/h5-20,28H,21H2,1-4H3;1H/q+1;/p-1