4-ethyl-6-nitro-N-octanoyl-pyridine-3-carboxamide

Systemtic Name: 4-ethyl-6-nitro-N-octanoyl-pyridine-3-carboxamide Openeye Name: 4-ethyl-6-nitro-N-octanoyl-pyridine-3-carboxamide CAS Name: 4-ethyl-6-nitro-N-(1-oxooctyl)-3-pyridinecarboxamide IUPAC Name: 4-ethyl-6-nitro-N-octanoylpyridine-3-carboxamide Traditional Name: N-caprylyl-4-ethyl-6-nitro-nicotinamide Formula: C16H23N3O4 MolecularWeight: 321.37152

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)NC(=O)C1=CN=C(C=C1CC)[N+](=O)[O-]

Isomeric SMILES

CCCCCCCC(=O)NC(=O)C1=CN=C(C=C1CC)[N+](=O)[O-]

InChI

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