(2Z)-2-[[(3-methyl-4-nitro-phenyl)amino]-oxidanyl-methylidene]-3-oxidanylidene-butanenitrile

Systemtic Name: (2Z)-2-[[(3-methyl-4-nitro-phenyl)amino]-oxidanyl-methylidene]-3-oxidanylidene-butanenitrile Openeye Name: (2Z)-2-[hydroxy-(3-methyl-4-nitro-anilino)methylene]-3-oxo-butanenitrile CAS Name: (2Z)-2-[hydroxy-(3-methyl-4-nitroanilino)methylidene]-3-oxobutanenitrile IUPAC Name: (2Z)-2-[hydroxy-(3-methyl-4-nitroanilino)methylidene]-3-oxobutanenitrile Traditional Name: (Z)-2-acetyl-3-hydroxy-3-(3-methyl-4-nitro-anilino)acrylonitrile Formula: C12H11N3O4 MolecularWeight: 261.23344

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H11N3O4/c1-7-5-9(3-4-11(7)15(18)19)14-12(17)10(6-13)8(2)16/h3-5,14,17H,1-2H3/b12-10-