ethyl 6-[azanyl(butyl)amino]-4-chloranyl-2-methyl-5-nitro-pyridine-3-carboxylate

Systemtic Name: ethyl 6-[azanyl(butyl)amino]-4-chloranyl-2-methyl-5-nitro-pyridine-3-carboxylate Openeye Name: ethyl 6-[amino(butyl)amino]-4-chloro-2-methyl-5-nitro-pyridine-3-carboxylate CAS Name: 6-[amino(butyl)amino]-4-chloro-2-methyl-5-nitro-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 6-[amino(butyl)amino]-4-chloro-2-methyl-5-nitropyridine-3-carboxylate Traditional Name: 6-[amino(butyl)amino]-4-chloro-2-methyl-5-nitro-nicotinic acid ethyl ester Formula: C13H19ClN4O4 MolecularWeight: 330.76736

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C1=C(C(=C(C(=N1)C)C(=O)OCC)Cl)[N+](=O)[O-])N

Isomeric SMILES

CCCCN(C1=C(C(=C(C(=N1)C)C(=O)OCC)Cl)[N+](=O)[O-])N

InChI

InChI=1S/C13H19ClN4O4/c1-4-6-7-17(15)12-11(18(20)21)10(14)9(8(3)16-12)13(19)22-5-2/h4-7,15H2,1-3H3