(5-carboxy-6-methyl-pyridin-1-ium-2-yl)methylazanium dichloride

Systemtic Name: (5-carboxy-6-methyl-pyridin-1-ium-2-yl)methylazanium dichloride Openeye Name: (5-carboxy-6-methyl-pyridin-1-ium-2-yl)methylammonium dichloride CAS Name: (5-carboxy-6-methyl-2-pyridin-1-iumyl)methylammonium dichloride IUPAC Name: (5-carboxy-6-methylpyridin-1-ium-2-yl)methylazanium dichloride Traditional Name: (5-carboxy-6-methyl-pyridin-1-ium-2-yl)methylammonium dichloride Formula: C8H12Cl2N2O2 MolecularWeight: 239.09908

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=[NH+]1)C[NH3+])C(=O)O.[Cl-].[Cl-]

Isomeric SMILES

CC1=C(C=CC(=[NH+]1)C[NH3+])C(=O)O.[Cl-].[Cl-]

InChI

InChI=1S/C8H10N2O2.2ClH/c1-5-7(8(11)12)3-2-6(4-9)10-5;;/h2-3H,4,9H2,1H3,(H,11,12);2*1H