[2-(3-dodecoxypyridin-1-ium-1-yl)-1-phosphono-ethyl]-oxidanyl-phosphinate

Systemtic Name: [2-(3-dodecoxypyridin-1-ium-1-yl)-1-phosphono-ethyl]-oxidanyl-phosphinate Openeye Name: [2-(3-dodecoxypyridin-1-ium-1-yl)-1-phosphono-ethyl]-hydroxy-phosphinate CAS Name: [2-(3-dodecoxy-1-pyridin-1-iumyl)-1-phosphonoethyl]-hydroxyphosphinate IUPAC Name: [2-(3-dodecoxypyridin-1-ium-1-yl)-1-phosphonoethyl]-hydroxyphosphinate Traditional Name: hydroxy-[2-(3-lauryloxypyridin-1-ium-1-yl)-1-phosphono-ethyl]phosphinate Formula: C19H35NO7P2 MolecularWeight: 451.431222

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC1=C[N+](=CC=C1)CC(P(=O)(O)O)P(=O)(O)[O-]

Isomeric SMILES

CCCCCCCCCCCCOC1=C[N+](=CC=C1)CC(P(=O)(O)O)P(=O)(O)[O-]

InChI

InChI=1S/C19H35NO7P2/c1-2-3-4-5-6-7-8-9-10-11-15-27-18-13-12-14-20(16-18)17-19(28(21,22)23)29(24,25)26/h12-14,16,19H,2-11,15,17H2,1H3,(H3-,21,22,23,24,25,26)