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

Systemtic Name: (2Z)-4,4-dimethyl-2-[[4-(2-methylphenoxy)-2-nitro-phenyl]-oxidanyl-methylidene]-3-oxidanylidene-pentanenitrile Openeye Name: (2Z)-2-[hydroxy-[4-(2-methylphenoxy)-2-nitro-phenyl]methylene]-4,4-dimethyl-3-oxo-pentanenitrile CAS Name: (2Z)-2-[hydroxy-[4-(2-methylphenoxy)-2-nitrophenyl]methylidene]-4,4-dimethyl-3-oxopentanenitrile IUPAC Name: (2Z)-2-[hydroxy-[4-(2-methylphenoxy)-2-nitrophenyl]methylidene]-4,4-dimethyl-3-oxopentanenitrile Traditional Name: (Z)-3-hydroxy-3-[4-(2-methylphenoxy)-2-nitro-phenyl]-2-pivaloyl-acrylonitrile Formula: C21H20N2O5 MolecularWeight: 380.3939

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OC2=CC(=C(C=C2)C(=C(C#N)C(=O)C(C)(C)C)O)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1OC2=CC(=C(C=C2)/C(=C(\C#N)/C(=O)C(C)(C)C)/O)[N+](=O)[O-]

InChI

InChI=1S/C21H20N2O5/c1-13-7-5-6-8-18(13)28-14-9-10-15(17(11-14)23(26)27)19(24)16(12-22)20(25)21(2,3)4/h5-11,24H,1-4H3/b19-16-