disodium; hydrogen phosphate; 2-(2-methyl-5-nitro-imidazol-1-yl)ethanol

Systemtic Name: disodium; hydrogen phosphate; 2-(2-methyl-5-nitro-imidazol-1-yl)ethanol Openeye Name: disodium; hydrogen phosphate; 2-(2-methyl-5-nitro-imidazol-1-yl)ethanol CAS Name: disodium; hydrogen phosphate; 2-(2-methyl-5-nitro-1-imidazolyl)ethanol IUPAC Name: disodium; hydrogen phosphate; 2-(2-methyl-5-nitroimidazol-1-yl)ethanol Traditional Name: disodium; hydrogen phosphate; 2-(2-methyl-5-nitro-imidazol-1-yl)ethanol Formula: C6H10N3Na2O7P MolecularWeight: 313.112801

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(N1CCO)[N+](=O)[O-].OP(=O)([O-])[O-].[Na+].[Na+]

Isomeric SMILES

CC1=NC=C(N1CCO)[N+](=O)[O-].OP(=O)([O-])[O-].[Na+].[Na+]

InChI

InChI=1S/C6H9N3O3.2Na.H3O4P/c1-5-7-4-6(9(11)12)8(5)2-3-10;;;1-5(2,3)4/h4,10H,2-3H2,1H3;;;(H3,1,2,3,4)/q;2*+1;/p-2