1-[(5-tert-butyl-1,2,4-oxadiazol-3-yl)methyl]-5-nitro-2-oxidanylidene-pyridine-3-carboxamide

Systemtic Name: 1-[(5-tert-butyl-1,2,4-oxadiazol-3-yl)methyl]-5-nitro-2-oxidanylidene-pyridine-3-carboxamide Openeye Name: 1-[(5-tert-butyl-1,2,4-oxadiazol-3-yl)methyl]-5-nitro-2-oxo-pyridine-3-carboxamide CAS Name: 1-[(5-tert-butyl-1,2,4-oxadiazol-3-yl)methyl]-5-nitro-2-oxo-3-pyridinecarboxamide IUPAC Name: 1-[(5-tert-butyl-1,2,4-oxadiazol-3-yl)methyl]-5-nitro-2-oxopyridine-3-carboxamide Traditional Name: 1-[(5-tert-butyl-1,2,4-oxadiazol-3-yl)methyl]-2-keto-5-nitro-nicotinamide Formula: C13H15N5O5 MolecularWeight: 321.2887

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NC(=NO1)CN2C=C(C=C(C2=O)C(=O)N)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C1=NC(=NO1)CN2C=C(C=C(C2=O)C(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C13H15N5O5/c1-13(2,3)12-15-9(16-23-12)6-17-5-7(18(21)22)4-8(10(14)19)11(17)20/h4-5H,6H2,1-3H3,(H2,14,19)