phenacyl(triphenyl)phosphanium ethanoate

Systemtic Name: phenacyl(triphenyl)phosphanium ethanoate Openeye Name: phenacyl(triphenyl)phosphonium acetate CAS Name: phenacyl(triphenyl)phosphonium acetate IUPAC Name: phenacyl(triphenyl)phosphanium acetate Traditional Name: phenacyl(triphenyl)phosphonium acetate Formula: C28H25O3P MolecularWeight: 440.470061

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H22OP.C2H4O2/c27-26(22-13-5-1-6-14-22)21-28(23-15-7-2-8-16-23,24-17-9-3-10-18-24)25-19-11-4-12-20-25;1-2(3)4/h1-20H,21H2;1H3,(H,3,4)/q+1;/p-1