1-(3,3-dimethyl-2-oxidanylidene-butyl)-5-nitro-2-oxidanylidene-pyridine-3-carbonitrile

Systemtic Name: 1-(3,3-dimethyl-2-oxidanylidene-butyl)-5-nitro-2-oxidanylidene-pyridine-3-carbonitrile Openeye Name: 1-(3,3-dimethyl-2-oxo-butyl)-5-nitro-2-oxo-pyridine-3-carbonitrile CAS Name: 1-(3,3-dimethyl-2-oxobutyl)-5-nitro-2-oxo-3-pyridinecarbonitrile IUPAC Name: 1-(3,3-dimethyl-2-oxobutyl)-5-nitro-2-oxopyridine-3-carbonitrile Traditional Name: 2-keto-1-(2-keto-3,3-dimethyl-butyl)-5-nitro-nicotinonitrile Formula: C12H13N3O4 MolecularWeight: 263.24932

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)CN1C=C(C=C(C1=O)C#N)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C(=O)CN1C=C(C=C(C1=O)C#N)[N+](=O)[O-]

InChI

InChI=1S/C12H13N3O4/c1-12(2,3)10(16)7-14-6-9(15(18)19)4-8(5-13)11(14)17/h4,6H,7H2,1-3H3