N-[(2S)-butan-2-yl]-2-(3-cyano-5-nitro-2-oxidanylidene-pyridin-1-yl)ethanamide

Systemtic Name: N-[(2S)-butan-2-yl]-2-(3-cyano-5-nitro-2-oxidanylidene-pyridin-1-yl)ethanamide Openeye Name: 2-(3-cyano-5-nitro-2-oxo-1-pyridyl)-N-[(1S)-1-methylpropyl]acetamide CAS Name: N-[(2S)-butan-2-yl]-2-(3-cyano-5-nitro-2-oxo-1-pyridinyl)acetamide IUPAC Name: N-[(2S)-butan-2-yl]-2-(3-cyano-5-nitro-2-oxopyridin-1-yl)acetamide Traditional Name: 2-(3-cyano-2-keto-5-nitro-1-pyridyl)-N-[(1S)-1-methylpropyl]acetamide Formula: C12H14N4O4 MolecularWeight: 278.26396

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H14N4O4/c1-3-8(2)14-11(17)7-15-6-10(16(19)20)4-9(5-13)12(15)18/h4,6,8H,3,7H2,1-2H3,(H,14,17)/t8-/m0/s1