cyclooctyl(triphenyl)phosphanium; ethanedioate

Systemtic Name: cyclooctyl(triphenyl)phosphanium; ethanedioate Openeye Name: cyclooctyl(triphenyl)phosphonium; oxalate CAS Name: cyclooctyl(triphenyl)phosphonium; oxalate IUPAC Name: cyclooctyl(triphenyl)phosphanium; oxalate Traditional Name: cyclooctyl(triphenyl)phosphonium; oxalate Formula: C54H60O4P2 MolecularWeight: 834.999322

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CCC1)[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.C1CCCC(CCC1)[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.C(=O)(C(=O)[O-])[O-]

Isomeric SMILES

C1CCCC(CCC1)[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.C1CCCC(CCC1)[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.C(=O)(C(=O)[O-])[O-]

InChI

InChI=1S/2C26H30P.C2H2O4/c2*1-2-7-15-23(16-8-3-1)27(24-17-9-4-10-18-24,25-19-11-5-12-20-25)26-21-13-6-14-22-26;3-1(4)2(5)6/h2*4-6,9-14,17-23H,1-3,7-8,15-16H2;(H,3,4)(H,5,6)/q2*+1;/p-2