tris(2-methylphenyl)-(3-oxidanylpropyl)phosphanium phosphate

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1[P+](CCCO)(C2=CC=CC=C2C)C3=CC=CC=C3C.[O-]P(=O)([O-])[O-]

Isomeric SMILES

CC1=CC=CC=C1[P+](CCCO)(C2=CC=CC=C2C)C3=CC=CC=C3C.[O-]P(=O)([O-])[O-]

InChI

InChI=1S/C24H28OP.H3O4P/c1-19-11-4-7-14-22(19)26(18-10-17-25,23-15-8-5-12-20(23)2)24-16-9-6-13-21(24)3;1-5(2,3)4/h4-9,11-16,25H,10,17-18H2,1-3H3;(H3,1,2,3,4)/q+1;/p-3