4-chloranyl-2-methyl-6-(2-methylpiperazin-1-yl)-5-nitro-pyridine-3-carboxylic acid

Systemtic Name: 4-chloranyl-2-methyl-6-(2-methylpiperazin-1-yl)-5-nitro-pyridine-3-carboxylic acid Openeye Name: 4-chloro-2-methyl-6-(2-methylpiperazin-1-yl)-5-nitro-pyridine-3-carboxylic acid CAS Name: 4-chloro-2-methyl-6-(2-methyl-1-piperazinyl)-5-nitro-3-pyridinecarboxylic acid IUPAC Name: 4-chloro-2-methyl-6-(2-methylpiperazin-1-yl)-5-nitropyridine-3-carboxylic acid Traditional Name: 4-chloro-2-methyl-6-(2-methylpiperazino)-5-nitro-nicotinic acid Formula: C12H15ClN4O4 MolecularWeight: 314.7249

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Descriptors Computed from Structure

Canonical SMILES:

CC1CNCCN1C2=C(C(=C(C(=N2)C)C(=O)O)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1CNCCN1C2=C(C(=C(C(=N2)C)C(=O)O)Cl)[N+](=O)[O-]

InChI

InChI=1S/C12H15ClN4O4/c1-6-5-14-3-4-16(6)11-10(17(20)21)9(13)8(12(18)19)7(2)15-11/h6,14H,3-5H2,1-2H3,(H,18,19)