(2Z)-2-[(4-fluoranyl-2-nitro-phenyl)-oxidanyl-methylidene]-4,4-dimethyl-3-oxidanylidene-pentanenitrile

Systemtic Name: (2Z)-2-[(4-fluoranyl-2-nitro-phenyl)-oxidanyl-methylidene]-4,4-dimethyl-3-oxidanylidene-pentanenitrile Openeye Name: (2Z)-2-[(4-fluoro-2-nitro-phenyl)-hydroxy-methylene]-4,4-dimethyl-3-oxo-pentanenitrile CAS Name: (2Z)-2-[(4-fluoro-2-nitrophenyl)-hydroxymethylidene]-4,4-dimethyl-3-oxopentanenitrile IUPAC Name: (2Z)-2-[(4-fluoro-2-nitrophenyl)-hydroxymethylidene]-4,4-dimethyl-3-oxopentanenitrile Traditional Name: (Z)-3-(4-fluoro-2-nitro-phenyl)-3-hydroxy-2-pivaloyl-acrylonitrile Formula: C14H13FN2O4 MolecularWeight: 292.262423

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(C)(C)C(=O)/C(=C(/C1=C(C=C(C=C1)F)[N+](=O)[O-])\O)/C#N

InChI

InChI=1S/C14H13FN2O4/c1-14(2,3)13(19)10(7-16)12(18)9-5-4-8(15)6-11(9)17(20)21/h4-6,18H,1-3H3/b12-10-