2-ethyl-6-nitro-N-octanoyl-pyridine-4-carboxamide

Systemtic Name: 2-ethyl-6-nitro-N-octanoyl-pyridine-4-carboxamide Openeye Name: 2-ethyl-6-nitro-N-octanoyl-pyridine-4-carboxamide CAS Name: 2-ethyl-6-nitro-N-(1-oxooctyl)-4-pyridinecarboxamide IUPAC Name: 2-ethyl-6-nitro-N-octanoylpyridine-4-carboxamide Traditional Name: N-caprylyl-2-ethyl-6-nitro-isonicotinamide Formula: C16H23N3O4 MolecularWeight: 321.37152

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H23N3O4/c1-3-5-6-7-8-9-15(20)18-16(21)12-10-13(4-2)17-14(11-12)19(22)23/h10-11H,3-9H2,1-2H3,(H,18,20,21)