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5-(chloromethyl)pyridin-1-ium-2,3-dicarboxylic acid nitrate

5-(chloromethyl)pyridin-1-ium-2,3-dicarboxylic acid nitrate

Systemtic Name:5-(chloromethyl)pyridin-1-ium-2,3-dicarboxylic acid nitrate
Openeye Name:5-(chloromethyl)pyridin-1-ium-2,3-dicarboxylic acid nitrate
CAS Name:5-(chloromethyl)pyridin-1-ium-2,3-dicarboxylic acid nitrate
IUPAC Name:5-(chloromethyl)pyridin-1-ium-2,3-dicarboxylic acid nitrate
Traditional Name:5-(chloromethyl)pyridin-1-ium-2,3-dicarboxylic acid nitrate
Formula: C8H7ClN2O7
MolecularWeight: 278.60338
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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=[NH+]C=C1CCl)C(=O)O)C(=O)O.[N+](=O)([O-])[O-]


Isomeric SMILES

C1=C(C(=[NH+]C=C1CCl)C(=O)O)C(=O)O.[N+](=O)([O-])[O-]


InChI

InChI=1S/C8H6ClNO4.NO3/c9-2-4-1-5(7(11)12)6(8(13)14)10-3-4;2-1(3)4/h1,3H,2H2,(H,11,12)(H,13,14);/q;-1/p+1


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