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

Systemtic Name: (2Z)-4,4-dimethyl-2-[(2-nitro-4-propoxy-phenyl)-oxidanyl-methylidene]-3-oxidanylidene-pentanenitrile Openeye Name: (2Z)-2-[hydroxy-(2-nitro-4-propoxy-phenyl)methylene]-4,4-dimethyl-3-oxo-pentanenitrile CAS Name: (2Z)-2-[hydroxy-(2-nitro-4-propoxyphenyl)methylidene]-4,4-dimethyl-3-oxopentanenitrile IUPAC Name: (2Z)-2-[hydroxy-(2-nitro-4-propoxyphenyl)methylidene]-4,4-dimethyl-3-oxopentanenitrile Traditional Name: (Z)-3-hydroxy-3-(2-nitro-4-propoxy-phenyl)-2-pivaloyl-acrylonitrile Formula: C17H20N2O5 MolecularWeight: 332.3511

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC(=C(C=C1)C(=C(C#N)C(=O)C(C)(C)C)O)[N+](=O)[O-]

Isomeric SMILES

CCCOC1=CC(=C(C=C1)/C(=C(\C#N)/C(=O)C(C)(C)C)/O)[N+](=O)[O-]

InChI

InChI=1S/C17H20N2O5/c1-5-8-24-11-6-7-12(14(9-11)19(22)23)15(20)13(10-18)16(21)17(2,3)4/h6-7,9,20H,5,8H2,1-4H3/b15-13-