2-chloranyl-4,6-dimethyl-5-nitro-pyridine-3-carboxylate

Systemtic Name: 2-chloranyl-4,6-dimethyl-5-nitro-pyridine-3-carboxylate Openeye Name: 2-chloro-4,6-dimethyl-5-nitro-pyridine-3-carboxylate CAS Name: 2-chloro-4,6-dimethyl-5-nitro-3-pyridinecarboxylate IUPAC Name: 2-chloro-4,6-dimethyl-5-nitropyridine-3-carboxylate Traditional Name: 2-chloro-4,6-dimethyl-5-nitro-nicotinate Formula: C8H6ClN2O4- MolecularWeight: 229.59724

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=C1[N+](=O)[O-])C)Cl)C(=O)[O-]

Isomeric SMILES

CC1=C(C(=NC(=C1[N+](=O)[O-])C)Cl)C(=O)[O-]

InChI

InChI=1S/C8H7ClN2O4/c1-3-5(8(12)13)7(9)10-4(2)6(3)11(14)15/h1-2H3,(H,12,13)/p-1