[bis(chloranyl)-phosphonato-methyl]-oxidanyl-phosphinate; tetrabutylazanium

Systemtic Name: [bis(chloranyl)-phosphonato-methyl]-oxidanyl-phosphinate; tetrabutylazanium Openeye Name: [dichloro(phosphonato)methyl]-hydroxy-phosphinate; tetrabutylammonium CAS Name: [dichloro(phosphonato)methyl]-hydroxyphosphinate; tetrabutylammonium IUPAC Name: [dichloro(phosphonato)methyl]-hydroxyphosphinate; tetrabutylazanium Traditional Name: [dichloro(phosphonato)methyl]-hydroxy-phosphinate; tetrabutylammonium Formula: C49H109Cl2N3O6P2 MolecularWeight: 969.259782

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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.C(P(=O)(O)[O-])(P(=O)([O-])[O-])(Cl)Cl

Isomeric SMILES

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

InChI

InChI=1S/3C16H36N.CH4Cl2O6P2/c3*1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4;2-1(3,10(4,5)6)11(7,8)9/h3*5-16H2,1-4H3;(H2,4,5,6)(H2,7,8,9)/q3*+1;/p-3