dimethyl 2,6-dimethyl-4-(5-nitro-1-oxidanidyl-pyridin-1-ium-3-yl)pyridine-3,5-dicarboxylate

Systemtic Name: dimethyl 2,6-dimethyl-4-(5-nitro-1-oxidanidyl-pyridin-1-ium-3-yl)pyridine-3,5-dicarboxylate Openeye Name: dimethyl 2,6-dimethyl-4-(5-nitro-1-oxido-pyridin-1-ium-3-yl)pyridine-3,5-dicarboxylate CAS Name: 2,6-dimethyl-4-(5-nitro-1-oxido-3-pyridin-1-iumyl)pyridine-3,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2,6-dimethyl-4-(5-nitro-1-oxidopyridin-1-ium-3-yl)pyridine-3,5-dicarboxylate Traditional Name: 2,6-dimethyl-4-(5-nitro-1-oxido-pyridin-1-ium-3-yl)pyridine-3,5-dicarboxylic acid dimethyl ester Formula: C16H15N3O7 MolecularWeight: 361.3062

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=N1)C)C(=O)OC)C2=CC(=C[N+](=C2)[O-])[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CC1=C(C(=C(C(=N1)C)C(=O)OC)C2=CC(=C[N+](=C2)[O-])[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C16H15N3O7/c1-8-12(15(20)25-3)14(13(9(2)17-8)16(21)26-4)10-5-11(19(23)24)7-18(22)6-10/h5-7H,1-4H3