4-[(E)-2-(1-methyl-5-nitro-imidazol-2-yl)ethenyl]benzenecarbonitrile

Systemtic Name: 4-[(E)-2-(1-methyl-5-nitro-imidazol-2-yl)ethenyl]benzenecarbonitrile Openeye Name: 4-[(E)-2-(1-methyl-5-nitro-imidazol-2-yl)vinyl]benzonitrile CAS Name: 4-[(E)-2-(1-methyl-5-nitro-2-imidazolyl)ethenyl]benzonitrile IUPAC Name: 4-[(E)-2-(1-methyl-5-nitroimidazol-2-yl)ethenyl]benzonitrile Traditional Name: 4-[(E)-2-(1-methyl-5-nitro-imidazol-2-yl)vinyl]benzonitrile Formula: C13H10N4O2 MolecularWeight: 254.2441

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CN=C1C=CC2=CC=C(C=C2)C#N)[N+](=O)[O-]

Isomeric SMILES

CN1C(=CN=C1/C=C/C2=CC=C(C=C2)C#N)[N+](=O)[O-]

InChI

InChI=1S/C13H10N4O2/c1-16-12(15-9-13(16)17(18)19)7-6-10-2-4-11(8-14)5-3-10/h2-7,9H,1H3/b7-6+