(2E)-2-[(4-chloranyl-5-methoxy-2-nitro-phenyl)-oxidanyl-methylidene]-4,4-dimethyl-3-oxidanylidene-pentanenitrile

Systemtic Name: (2E)-2-[(4-chloranyl-5-methoxy-2-nitro-phenyl)-oxidanyl-methylidene]-4,4-dimethyl-3-oxidanylidene-pentanenitrile Openeye Name: (2E)-2-[(4-chloro-5-methoxy-2-nitro-phenyl)-hydroxy-methylene]-4,4-dimethyl-3-oxo-pentanenitrile CAS Name: (2E)-2-[(4-chloro-5-methoxy-2-nitrophenyl)-hydroxymethylidene]-4,4-dimethyl-3-oxopentanenitrile IUPAC Name: (2E)-2-[(4-chloro-5-methoxy-2-nitrophenyl)-hydroxymethylidene]-4,4-dimethyl-3-oxopentanenitrile Traditional Name: (E)-3-(4-chloro-5-methoxy-2-nitro-phenyl)-3-hydroxy-2-pivaloyl-acrylonitrile Formula: C15H15ClN2O5 MolecularWeight: 338.743

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H15ClN2O5/c1-15(2,3)14(20)9(7-17)13(19)8-5-12(23-4)10(16)6-11(8)18(21)22/h5-6,19H,1-4H3/b13-9+