ethanoic acid; (4-methoxyphenyl)methyl-triphenyl-phosphanium; ethanoate

Systemtic Name: ethanoic acid; (4-methoxyphenyl)methyl-triphenyl-phosphanium; ethanoate Openeye Name: acetic acid; (4-methoxyphenyl)methyl-triphenyl-phosphonium; acetate CAS Name: acetic acid; (4-methoxyphenyl)methyl-triphenylphosphonium; acetate IUPAC Name: acetic acid; (4-methoxyphenyl)methyl-triphenylphosphanium; acetate Traditional Name: acetic acid; p-anisyl(triphenyl)phosphonium; acetate Formula: C30H31O5P MolecularWeight: 502.537901

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)O.CC(=O)[O-].COC1=CC=C(C=C1)C[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(=O)O.CC(=O)[O-].COC1=CC=C(C=C1)C[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C26H24OP.2C2H4O2/c1-27-23-19-17-22(18-20-23)21-28(24-11-5-2-6-12-24,25-13-7-3-8-14-25)26-15-9-4-10-16-26;2*1-2(3)4/h2-20H,21H2,1H3;2*1H3,(H,3,4)/q+1;;/p-1