methanol; tetrabutylazanium; phosphate

Systemtic Name: methanol; tetrabutylazanium; phosphate Openeye Name: methanol; tetrabutylammonium; phosphate CAS Name: methanol; tetrabutylammonium; phosphate IUPAC Name: methanol; tetrabutylazanium; phosphate Traditional Name: methanol; tetrabutylammonium; phosphate Formula: C49H112N3O5P MolecularWeight: 854.404441

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[N+](CCCC)(CCCC)CCCC.CCCC[N+](CCCC)(CCCC)CCCC.CCCC[N+](CCCC)(CCCC)CCCC.CO.[O-]P(=O)([O-])[O-]

Isomeric SMILES

CCCC[N+](CCCC)(CCCC)CCCC.CCCC[N+](CCCC)(CCCC)CCCC.CCCC[N+](CCCC)(CCCC)CCCC.CO.[O-]P(=O)([O-])[O-]

InChI

InChI=1S/3C16H36N.CH4O.H3O4P/c3*1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4;1-2;1-5(2,3)4/h3*5-16H2,1-4H3;2H,1H3;(H3,1,2,3,4)/q3*+1;;/p-3