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

Systemtic Name: (2Z)-2-[(4-chloranyl-5-methyl-2-nitro-phenyl)-oxidanyl-methylidene]-4,4-dimethyl-3-oxidanylidene-pentanenitrile Openeye Name: (2Z)-2-[(4-chloro-5-methyl-2-nitro-phenyl)-hydroxy-methylene]-4,4-dimethyl-3-oxo-pentanenitrile CAS Name: (2Z)-2-[(4-chloro-5-methyl-2-nitrophenyl)-hydroxymethylidene]-4,4-dimethyl-3-oxopentanenitrile IUPAC Name: (2Z)-2-[(4-chloro-5-methyl-2-nitrophenyl)-hydroxymethylidene]-4,4-dimethyl-3-oxopentanenitrile Traditional Name: (Z)-3-(4-chloro-5-methyl-2-nitro-phenyl)-3-hydroxy-2-pivaloyl-acrylonitrile Formula: C15H15ClN2O4 MolecularWeight: 322.7436

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C(=C1)C(=C(C#N)C(=O)C(C)(C)C)O)[N+](=O)[O-])Cl

Isomeric SMILES

CC1=C(C=C(C(=C1)/C(=C(\C#N)/C(=O)C(C)(C)C)/O)[N+](=O)[O-])Cl

InChI

InChI=1S/C15H15ClN2O4/c1-8-5-9(12(18(21)22)6-11(8)16)13(19)10(7-17)14(20)15(2,3)4/h5-6,19H,1-4H3/b13-10-