tris(4-methylphenyl)-(3-oxidanylpropyl)phosphanium phosphate

Systemtic Name: tris(4-methylphenyl)-(3-oxidanylpropyl)phosphanium phosphate Openeye Name: 3-hydroxypropyl(tris-p-tolyl)phosphonium phosphate CAS Name: 3-hydroxypropyl-tris(4-methylphenyl)phosphonium phosphate IUPAC Name: 3-hydroxypropyl-tris(4-methylphenyl)phosphanium phosphate Traditional Name: 3-hydroxypropyl(tris-p-tolyl)phosphonium phosphate Formula: C24H28O5P2-2 MolecularWeight: 458.423642

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)[P+](CCCO)(C2=CC=C(C=C2)C)C3=CC=C(C=C3)C.[O-]P(=O)([O-])[O-]

Isomeric SMILES

CC1=CC=C(C=C1)[P+](CCCO)(C2=CC=C(C=C2)C)C3=CC=C(C=C3)C.[O-]P(=O)([O-])[O-]

InChI

InChI=1S/C24H28OP.H3O4P/c1-19-5-11-22(12-6-19)26(18-4-17-25,23-13-7-20(2)8-14-23)24-15-9-21(3)10-16-24;1-5(2,3)4/h5-16,25H,4,17-18H2,1-3H3;(H3,1,2,3,4)/q+1;/p-3