calcium [1-[oxidanidyl(oxidanyl)phosphoryl]-1-oxidanyl-2-pyridin-3-yl-ethyl]-oxidanyl-phosphinate

Systemtic Name: calcium [1-[oxidanidyl(oxidanyl)phosphoryl]-1-oxidanyl-2-pyridin-3-yl-ethyl]-oxidanyl-phosphinate Openeye Name: calcium hydroxy-[1-hydroxy-1-[hydroxy(oxido)phosphoryl]-2-(3-pyridyl)ethyl]phosphinate CAS Name: calcium hydroxy-[1-hydroxy-1-[hydroxy(oxido)phosphoryl]-2-(3-pyridinyl)ethyl]phosphinate IUPAC Name: calcium hydroxy-[1-hydroxy-1-[hydroxy(oxido)phosphoryl]-2-pyridin-3-ylethyl]phosphinate Traditional Name: calcium hydroxy-[1-hydroxy-1-[hydroxy(oxido)phosphoryl]-2-(3-pyridyl)ethyl]phosphinate Formula: C7H9CaNO7P2 MolecularWeight: 321.174382

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)CC(O)(P(=O)(O)[O-])P(=O)(O)[O-].[Ca+2]

Isomeric SMILES

C1=CC(=CN=C1)CC(O)(P(=O)(O)[O-])P(=O)(O)[O-].[Ca+2]

InChI

InChI=1S/C7H11NO7P2.Ca/c9-7(16(10,11)12,17(13,14)15)4-6-2-1-3-8-5-6;/h1-3,5,9H,4H2,(H2,10,11,12)(H2,13,14,15);/q;+2/p-2