phosphonato phosphate; tetrabutylazanium

Systemtic Name: phosphonato phosphate; tetrabutylazanium Openeye Name: phosphonato phosphate; tetrabutylammonium CAS Name: phosphonato phosphate; tetrabutylammonium IUPAC Name: phosphonato phosphate; tetrabutylazanium Traditional Name: phosphonato phosphate; tetrabutylammonium Formula: C64H144N4O7P2 MolecularWeight: 1143.798282

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

Isomeric SMILES

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

InChI

InChI=1S/4C16H36N.H4O7P2/c4*1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4;1-8(2,3)7-9(4,5)6/h4*5-16H2,1-4H3;(H2,1,2,3)(H2,4,5,6)/q4*+1;/p-4