4-(butylamino)-6-chloranyl-2-methyl-5-nitro-pyridine-3-carboxylic acid

Systemtic Name: 4-(butylamino)-6-chloranyl-2-methyl-5-nitro-pyridine-3-carboxylic acid Openeye Name: 4-(butylamino)-6-chloro-2-methyl-5-nitro-pyridine-3-carboxylic acid CAS Name: 4-(butylamino)-6-chloro-2-methyl-5-nitro-3-pyridinecarboxylic acid IUPAC Name: 4-(butylamino)-6-chloro-2-methyl-5-nitropyridine-3-carboxylic acid Traditional Name: 4-(butylamino)-6-chloro-2-methyl-5-nitro-nicotinic acid Formula: C11H14ClN3O4 MolecularWeight: 287.69956

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=C(C(=NC(=C1[N+](=O)[O-])Cl)C)C(=O)O

Isomeric SMILES

CCCCNC1=C(C(=NC(=C1[N+](=O)[O-])Cl)C)C(=O)O

InChI

InChI=1S/C11H14ClN3O4/c1-3-4-5-13-8-7(11(16)17)6(2)14-10(12)9(8)15(18)19/h3-5H2,1-2H3,(H,13,14)(H,16,17)