[2-(1,1-dimethyl-2-oxidanylidene-piperidin-1-ium-3-yl)-1-phosphono-ethyl]phosphonic acid

Systemtic Name: [2-(1,1-dimethyl-2-oxidanylidene-piperidin-1-ium-3-yl)-1-phosphono-ethyl]phosphonic acid Openeye Name: [2-(1,1-dimethyl-2-oxo-piperidin-1-ium-3-yl)-1-phosphono-ethyl]phosphonic acid CAS Name: [2-(1,1-dimethyl-2-oxo-3-piperidin-1-iumyl)-1-phosphonoethyl]phosphonic acid IUPAC Name: [2-(1,1-dimethyl-2-oxopiperidin-1-ium-3-yl)-1-phosphonoethyl]phosphonic acid Traditional Name: [2-(2-keto-1,1-dimethyl-piperidin-1-ium-3-yl)-1-phosphono-ethyl]phosphonic acid Formula: C9H20NO7P2+ MolecularWeight: 316.205122

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCCC(C1=O)CC(P(=O)(O)O)P(=O)(O)O)C

Isomeric SMILES

C[N+]1(CCCC(C1=O)CC(P(=O)(O)O)P(=O)(O)O)C

InChI

InChI=1S/C9H19NO7P2/c1-10(2)5-3-4-7(9(10)11)6-8(18(12,13)14)19(15,16)17/h7-8H,3-6H2,1-2H3,(H3-,12,13,14,15,16,17)/p+1