(3-methoxy-4-oxidanylidene-3,4-diphenyl-butyl)-triphenyl-phosphanium iodide

Systemtic Name: (3-methoxy-4-oxidanylidene-3,4-diphenyl-butyl)-triphenyl-phosphanium iodide Openeye Name: (3-methoxy-4-oxo-3,4-diphenyl-butyl)-triphenyl-phosphonium iodide CAS Name: (3-methoxy-4-oxo-3,4-diphenylbutyl)-triphenylphosphonium iodide IUPAC Name: (3-methoxy-4-oxo-3,4-diphenylbutyl)-triphenylphosphanium iodide Traditional Name: (4-keto-3-methoxy-3,4-diphenyl-butyl)-triphenyl-phosphonium iodide Formula: C35H32IO2P MolecularWeight: 642.505611

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Descriptors Computed from Structure

Canonical SMILES:

COC(CC[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)(C4=CC=CC=C4)C(=O)C5=CC=CC=C5.[I-]

Isomeric SMILES

COC(CC[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)(C4=CC=CC=C4)C(=O)C5=CC=CC=C5.[I-]

InChI

InChI=1S/C35H32O2P.HI/c1-37-35(30-19-9-3-10-20-30,34(36)29-17-7-2-8-18-29)27-28-38(31-21-11-4-12-22-31,32-23-13-5-14-24-32)33-25-15-6-16-26-33;/h2-26H,27-28H2,1H3;1H/q+1;/p-1