[[(2Z,6Z)-11-methyl-3-(2-methylpropyl)-7-prop-2-enyl-dodeca-2,6,10-trienoxy]-oxidanidyl-phosphoryl] phosphate; tetrabutylazanium

Systemtic Name: [[(2Z,6Z)-11-methyl-3-(2-methylpropyl)-7-prop-2-enyl-dodeca-2,6,10-trienoxy]-oxidanidyl-phosphoryl] phosphate; tetrabutylazanium Openeye Name: [[(2Z,6Z)-7-allyl-3-isobutyl-11-methyl-dodeca-2,6,10-trienoxy]-oxido-phosphoryl] phosphate; tetrabutylammonium CAS Name: [[(2Z,6Z)-11-methyl-3-(2-methylpropyl)-7-prop-2-enyldodeca-2,6,10-trienoxy]-oxidophosphoryl] phosphate; tetrabutylammonium IUPAC Name: [[(2Z,6Z)-11-methyl-3-(2-methylpropyl)-7-prop-2-enyldodeca-2,6,10-trienoxy]-oxidophosphoryl] phosphate; tetrabutylazanium Traditional Name: [[(2Z,6Z)-7-allyl-3-isobutyl-11-methyl-dodeca-2,6,10-trienoxy]-oxido-phosphoryl] phosphate; tetrabutylammonium Formula: C68H141N3O7P2 MolecularWeight: 1174.810562

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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(C)CC(=CCOP(=O)([O-])OP(=O)([O-])[O-])CCC=C(CCC=C(C)C)CC=C

Isomeric SMILES

CCCC[N+](CCCC)(CCCC)CCCC.CCCC[N+](CCCC)(CCCC)CCCC.CCCC[N+](CCCC)(CCCC)CCCC.CC(C)C/C(=C\COP(=O)([O-])OP(=O)([O-])[O-])/CC/C=C(/CCC=C(C)C)\CC=C

InChI

InChI=1S/C20H36O7P2.3C16H36N/c1-6-9-19(11-7-10-17(2)3)12-8-13-20(16-18(4)5)14-15-26-29(24,25)27-28(21,22)23;3*1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4/h6,10,12,14,18H,1,7-9,11,13,15-16H2,2-5H3,(H,24,25)(H2,21,22,23);3*5-16H2,1-4H3/q;3*+1/p-3/b19-12+,20-14-;;;