2-ethylhexyl(triphenyl)phosphanium; tetraphenoxyalumanuide

Systemtic Name: 2-ethylhexyl(triphenyl)phosphanium; tetraphenoxyalumanuide Openeye Name: 2-ethylhexyl(triphenyl)phosphonium; tetraphenoxyalumanuide CAS Name: 2-ethylhexyl(triphenyl)phosphonium; tetraphenoxyalumanuide IUPAC Name: 2-ethylhexyl(triphenyl)phosphanium; tetraphenoxyalumanuide Traditional Name: 2-ethylhexyl(triphenyl)phosphonium; tetraphenoxyalumanuide Formula: C50H52AlO4P MolecularWeight: 774.900779

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)O[Al-](OC2=CC=CC=C2)(OC3=CC=CC=C3)OC4=CC=CC=C4

Isomeric SMILES

CCCCC(CC)C[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)O[Al-](OC2=CC=CC=C2)(OC3=CC=CC=C3)OC4=CC=CC=C4

InChI

InChI=1S/C26H32P.4C6H6O.Al/c1-3-5-15-23(4-2)22-27(24-16-9-6-10-17-24,25-18-11-7-12-19-25)26-20-13-8-14-21-26;4*7-6-4-2-1-3-5-6;/h6-14,16-21,23H,3-5,15,22H2,1-2H3;4*1-5,7H;/q+1;;;;;+3/p-4