(9-ethoxy-9-oxidanylidene-nonyl)-triphenyl-phosphanium iodide

Systemtic Name: (9-ethoxy-9-oxidanylidene-nonyl)-triphenyl-phosphanium iodide Openeye Name: (9-ethoxy-9-oxo-nonyl)-triphenyl-phosphonium iodide CAS Name: (9-ethoxy-9-oxononyl)-triphenylphosphonium iodide IUPAC Name: (9-ethoxy-9-oxononyl)-triphenylphosphanium iodide Traditional Name: (9-ethoxy-9-keto-nonyl)-triphenyl-phosphonium iodide Formula: C29H36IO2P MolecularWeight: 574.473171

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCCCCCC[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3.[I-]

Isomeric SMILES

CCOC(=O)CCCCCCCC[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3.[I-]

InChI

InChI=1S/C29H36O2P.HI/c1-2-31-29(30)24-16-5-3-4-6-17-25-32(26-18-10-7-11-19-26,27-20-12-8-13-21-27)28-22-14-9-15-23-28;/h7-15,18-23H,2-6,16-17,24-25H2,1H3;1H/q+1;/p-1