cyclobutyl(triphenyl)phosphanium; ethanedioate

Systemtic Name: cyclobutyl(triphenyl)phosphanium; ethanedioate Openeye Name: cyclobutyl(triphenyl)phosphonium; oxalate CAS Name: cyclobutyl(triphenyl)phosphonium; oxalate IUPAC Name: cyclobutyl(triphenyl)phosphanium; oxalate Traditional Name: cyclobutyl(triphenyl)phosphonium; oxalate Formula: C46H44O4P2 MolecularWeight: 722.786682

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.C1CC(C1)[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.C(=O)(C(=O)[O-])[O-]

Isomeric SMILES

C1CC(C1)[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.C1CC(C1)[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.C(=O)(C(=O)[O-])[O-]

InChI

InChI=1S/2C22H22P.C2H2O4/c2*1-4-11-19(12-5-1)23(22-17-10-18-22,20-13-6-2-7-14-20)21-15-8-3-9-16-21;3-1(4)2(5)6/h2*1-9,11-16,22H,10,17-18H2;(H,3,4)(H,5,6)/q2*+1;/p-2