tetrakis[butyl-(4-methoxyphenyl)amino]phosphanium iodide

Systemtic Name: tetrakis[butyl-(4-methoxyphenyl)amino]phosphanium iodide Openeye Name: tetrakis(N-butyl-4-methoxy-anilino)phosphonium iodide CAS Name: tetrakis(N-butyl-4-methoxyanilino)phosphonium iodide IUPAC Name: tetrakis(N-butyl-4-methoxyanilino)phosphanium iodide Traditional Name: tetrakis(N-butyl-4-methoxy-anilino)phosphonium iodide Formula: C44H64IN4O4P MolecularWeight: 870.881591

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C1=CC=C(C=C1)OC)[P+](N(CCCC)C2=CC=C(C=C2)OC)(N(CCCC)C3=CC=C(C=C3)OC)N(CCCC)C4=CC=C(C=C4)OC.[I-]

Isomeric SMILES

CCCCN(C1=CC=C(C=C1)OC)[P+](N(CCCC)C2=CC=C(C=C2)OC)(N(CCCC)C3=CC=C(C=C3)OC)N(CCCC)C4=CC=C(C=C4)OC.[I-]

InChI

InChI=1S/C44H64N4O4P.HI/c1-9-13-33-45(37-17-25-41(49-5)26-18-37)53(46(34-14-10-2)38-19-27-42(50-6)28-20-38,47(35-15-11-3)39-21-29-43(51-7)30-22-39)48(36-16-12-4)40-23-31-44(52-8)32-24-40;/h17-32H,9-16,33-36H2,1-8H3;1H/q+1;/p-1