(5-cyano-1-ethyl-indol-2-yl)methyl-triphenyl-phosphanium bromide

Systemtic Name: (5-cyano-1-ethyl-indol-2-yl)methyl-triphenyl-phosphanium bromide Openeye Name: (5-cyano-1-ethyl-indol-2-yl)methyl-triphenyl-phosphonium bromide CAS Name: (5-cyano-1-ethyl-2-indolyl)methyl-triphenylphosphonium bromide IUPAC Name: (5-cyano-1-ethylindol-2-yl)methyl-triphenylphosphanium bromide Traditional Name: (5-cyano-1-ethyl-indol-2-yl)methyl-triphenyl-phosphonium bromide Formula: C30H26BrN2P MolecularWeight: 525.418601

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C#N)C=C1C[P+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5.[Br-]

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C#N)C=C1C[P+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5.[Br-]

InChI

InChI=1S/C30H26N2P.BrH/c1-2-32-26(21-25-20-24(22-31)18-19-30(25)32)23-33(27-12-6-3-7-13-27,28-14-8-4-9-15-28)29-16-10-5-11-17-29;/h3-21H,2,23H2,1H3;1H/q+1;/p-1