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

Systemtic Name: (2Z)-2-[(4-chloranyl-2-nitro-phenyl)methylidene]-4-methyl-3-oxidanylidene-pentanenitrile Openeye Name: (2Z)-2-[(4-chloro-2-nitro-phenyl)methylene]-4-methyl-3-oxo-pentanenitrile CAS Name: (2Z)-2-[(4-chloro-2-nitrophenyl)methylidene]-4-methyl-3-oxopentanenitrile IUPAC Name: (2Z)-2-[(4-chloro-2-nitrophenyl)methylidene]-4-methyl-3-oxopentanenitrile Traditional Name: (Z)-3-(4-chloro-2-nitro-phenyl)-2-isobutyryl-acrylonitrile Formula: C13H11ClN2O3 MolecularWeight: 278.69104

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H11ClN2O3/c1-8(2)13(17)10(7-15)5-9-3-4-11(14)6-12(9)16(18)19/h3-6,8H,1-2H3/b10-5-