[(E)-3-methyl-4-(oxan-2-yloxy)but-2-enyl]sulfanyl-phosphonatooxy-phosphinate; tetrabutylazanium

Systemtic Name: [(E)-3-methyl-4-(oxan-2-yloxy)but-2-enyl]sulfanyl-phosphonatooxy-phosphinate; tetrabutylazanium Openeye Name: [(E)-3-methyl-4-tetrahydropyran-2-yloxy-but-2-enyl]sulfanyl-phosphonatooxy-phosphinate; tetrabutylammonium CAS Name: [[(E)-3-methyl-4-(2-oxanyloxy)but-2-enyl]thio]-phosphonatooxyphosphinate; tetrabutylammonium IUPAC Name: [(E)-3-methyl-4-(oxan-2-yloxy)but-2-enyl]sulfanyl-phosphonatooxyphosphinate; tetrabutylazanium Traditional Name: [[(E)-3-methyl-4-tetrahydropyran-2-yloxy-but-2-enyl]thio]-phosphato-phosphinate; tetrabutylammonium Formula: C58H125N3O8P2S MolecularWeight: 1086.640922

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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.CC(=CCSP(=O)([O-])OP(=O)([O-])[O-])COC1CCCCO1

Isomeric SMILES

CCCC[N+](CCCC)(CCCC)CCCC.CCCC[N+](CCCC)(CCCC)CCCC.CCCC[N+](CCCC)(CCCC)CCCC.C/C(=C\CSP(=O)([O-])OP(=O)([O-])[O-])/COC1CCCCO1

InChI

InChI=1S/3C16H36N.C10H20O8P2S/c3*1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4;1-9(8-17-10-4-2-3-6-16-10)5-7-21-20(14,15)18-19(11,12)13/h3*5-16H2,1-4H3;5,10H,2-4,6-8H2,1H3,(H,14,15)(H2,11,12,13)/q3*+1;/p-3/b;;;9-5+