3-nitro-N-octanoyl-pyridine-4-carboxamide

Systemtic Name: 3-nitro-N-octanoyl-pyridine-4-carboxamide Openeye Name: 3-nitro-N-octanoyl-pyridine-4-carboxamide CAS Name: 3-nitro-N-(1-oxooctyl)-4-pyridinecarboxamide IUPAC Name: 3-nitro-N-octanoylpyridine-4-carboxamide Traditional Name: N-caprylyl-3-nitro-isonicotinamide Formula: C14H19N3O4 MolecularWeight: 293.31836

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H19N3O4/c1-2-3-4-5-6-7-13(18)16-14(19)11-8-9-15-10-12(11)17(20)21/h8-10H,2-7H2,1H3,(H,16,18,19)