tris[heptyl-(2-methylphenyl)amino]-[heptyl(phenyl)amino]phosphanium iodide

Systemtic Name: tris[heptyl-(2-methylphenyl)amino]-[heptyl(phenyl)amino]phosphanium iodide Openeye Name: (N-heptylanilino)-tris(N-heptyl-2-methyl-anilino)phosphonium iodide CAS Name: (N-heptylanilino)-tris(N-heptyl-2-methylanilino)phosphonium iodide IUPAC Name: (N-heptylanilino)-tris(N-heptyl-2-methylanilino)phosphanium iodide Traditional Name: (N-heptylanilino)-tris(N-heptyl-2-methyl-anilino)phosphonium iodide Formula: C55H86IN4P MolecularWeight: 961.176371

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCN(C1=CC=CC=C1)[P+](N(CCCCCCC)C2=CC=CC=C2C)(N(CCCCCCC)C3=CC=CC=C3C)N(CCCCCCC)C4=CC=CC=C4C.[I-]

Isomeric SMILES

CCCCCCCN(C1=CC=CC=C1)[P+](N(CCCCCCC)C2=CC=CC=C2C)(N(CCCCCCC)C3=CC=CC=C3C)N(CCCCCCC)C4=CC=CC=C4C.[I-]

InChI

InChI=1S/C55H86N4P.HI/c1-8-12-16-20-33-45-56(52-40-25-24-26-41-52)60(57(46-34-21-17-13-9-2)53-42-30-27-37-49(53)5,58(47-35-22-18-14-10-3)54-43-31-28-38-50(54)6)59(48-36-23-19-15-11-4)55-44-32-29-39-51(55)7;/h24-32,37-44H,8-23,33-36,45-48H2,1-7H3;1H/q+1;/p-1