1-tert-butyl-5-nitro-2-oxidanylidene-N-prop-2-enyl-pyridine-3-carboxamide

Systemtic Name: 1-tert-butyl-5-nitro-2-oxidanylidene-N-prop-2-enyl-pyridine-3-carboxamide Openeye Name: N-allyl-1-tert-butyl-5-nitro-2-oxo-pyridine-3-carboxamide CAS Name: 1-tert-butyl-5-nitro-2-oxo-N-prop-2-enyl-3-pyridinecarboxamide IUPAC Name: 1-tert-butyl-5-nitro-2-oxo-N-prop-2-enylpyridine-3-carboxamide Traditional Name: N-allyl-1-tert-butyl-2-keto-5-nitro-nicotinamide Formula: C13H17N3O4 MolecularWeight: 279.29178

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C=C(C=C(C1=O)C(=O)NCC=C)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)N1C=C(C=C(C1=O)C(=O)NCC=C)[N+](=O)[O-]

InChI

InChI=1S/C13H17N3O4/c1-5-6-14-11(17)10-7-9(16(19)20)8-15(12(10)18)13(2,3)4/h5,7-8H,1,6H2,2-4H3,(H,14,17)