1-iodanylbutyl(triphenyl)phosphanium ethanoate

Systemtic Name: 1-iodanylbutyl(triphenyl)phosphanium ethanoate Openeye Name: 1-iodobutyl(triphenyl)phosphonium acetate CAS Name: 1-iodobutyl(triphenyl)phosphonium acetate IUPAC Name: 1-iodobutyl(triphenyl)phosphanium acetate Traditional Name: 1-iodobutyl(triphenyl)phosphonium acetate Formula: C24H26IO2P MolecularWeight: 504.340271

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Descriptors Computed from Structure

Canonical SMILES:

CCCC([P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)I.CC(=O)[O-]

Isomeric SMILES

CCCC([P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)I.CC(=O)[O-]

InChI

InChI=1S/C22H23IP.C2H4O2/c1-2-12-22(23)24(19-13-6-3-7-14-19,20-15-8-4-9-16-20)21-17-10-5-11-18-21;1-2(3)4/h3-11,13-18,22H,2,12H2,1H3;1H3,(H,3,4)/q+1;/p-1