3-(azanylidynemethyl)propyl-triphenyl-phosphanium iodide

Systemtic Name: 3-(azanylidynemethyl)propyl-triphenyl-phosphanium iodide Openeye Name: 3-(nitridomethyl)propyl-triphenyl-phosphonium iodide CAS Name: 3-(nitrilomethyl)propyl-triphenylphosphonium iodide IUPAC Name: 3-(azanylidynemethyl)propyl-triphenylphosphanium iodide Traditional Name: 3-(nitrilomethyl)propyl-triphenyl-phosphonium iodide Formula: C22H21INP MolecularWeight: 456.287805

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)[P+](CCCC#N)(C2=CC=CC=C2)C3=CC=CC=C3.[I-]

Isomeric SMILES

C1=CC=C(C=C1)[P+](CCC[11C]#N)(C2=CC=CC=C2)C3=CC=CC=C3.[I-]

InChI

InChI=1S/C22H21NP.HI/c23-18-10-11-19-24(20-12-4-1-5-13-20,21-14-6-2-7-15-21)22-16-8-3-9-17-22;/h1-9,12-17H,10-11,19H2;1H/q+1;/p-1/i18-1;