N-hexanoyl-4,5-dimethyl-6-nitro-pyridine-3-carboxamide

Systemtic Name: N-hexanoyl-4,5-dimethyl-6-nitro-pyridine-3-carboxamide Openeye Name: N-hexanoyl-4,5-dimethyl-6-nitro-pyridine-3-carboxamide CAS Name: 4,5-dimethyl-6-nitro-N-(1-oxohexyl)-3-pyridinecarboxamide IUPAC Name: N-hexanoyl-4,5-dimethyl-6-nitropyridine-3-carboxamide Traditional Name: N-caproyl-4,5-dimethyl-6-nitro-nicotinamide Formula: C14H19N3O4 MolecularWeight: 293.31836

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)NC(=O)C1=CN=C(C(=C1C)C)[N+](=O)[O-]

Isomeric SMILES

CCCCCC(=O)NC(=O)C1=CN=C(C(=C1C)C)[N+](=O)[O-]

InChI

InChI=1S/C14H19N3O4/c1-4-5-6-7-12(18)16-14(19)11-8-15-13(17(20)21)10(3)9(11)2/h8H,4-7H2,1-3H3,(H,16,18,19)