5-ethylpyridin-1-ium-2,3-dicarboxylic acid nitrate

Systemtic Name: 5-ethylpyridin-1-ium-2,3-dicarboxylic acid nitrate Openeye Name: 5-ethylpyridin-1-ium-2,3-dicarboxylic acid nitrate CAS Name: 5-ethylpyridin-1-ium-2,3-dicarboxylic acid nitrate IUPAC Name: 5-ethylpyridin-1-ium-2,3-dicarboxylic acid nitrate Traditional Name: 5-ethylpyridin-1-ium-2,3-dicarboxylic acid nitrate Formula: C9H10N2O7 MolecularWeight: 258.1849

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C[NH+]=C(C(=C1)C(=O)O)C(=O)O.[N+](=O)([O-])[O-]

Isomeric SMILES

CCC1=C[NH+]=C(C(=C1)C(=O)O)C(=O)O.[N+](=O)([O-])[O-]

InChI

InChI=1S/C9H9NO4.NO3/c1-2-5-3-6(8(11)12)7(9(13)14)10-4-5;2-1(3)4/h3-4H,2H2,1H3,(H,11,12)(H,13,14);/q;-1/p+1