dihydrogen phosphate; 3-(3-methylimidazol-3-ium-1-yl)propanoic acid

Systemtic Name: dihydrogen phosphate; 3-(3-methylimidazol-3-ium-1-yl)propanoic acid Openeye Name: dihydrogen phosphate; 3-(3-methylimidazol-3-ium-1-yl)propanoic acid CAS Name: dihydrogen phosphate; 3-(3-methyl-1-imidazol-3-iumyl)propanoic acid IUPAC Name: dihydrogen phosphate; 3-(3-methylimidazol-3-ium-1-yl)propanoic acid Traditional Name: dihydrogen phosphate; 3-(3-methylimidazol-3-ium-1-yl)propionic acid Formula: C7H13N2O6P MolecularWeight: 252.161681

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CN(C=C1)CCC(=O)O.OP(=O)(O)[O-]

Isomeric SMILES

C[N+]1=CN(C=C1)CCC(=O)O.OP(=O)(O)[O-]

InChI

InChI=1S/C7H10N2O2.H3O4P/c1-8-4-5-9(6-8)3-2-7(10)11;1-5(2,3)4/h4-6H,2-3H2,1H3;(H3,1,2,3,4)