methyl (E)-N-(5-cyano-1H-imidazol-4-yl)benzenecarboximidate

Systemtic Name: methyl (E)-N-(5-cyano-1H-imidazol-4-yl)benzenecarboximidate Openeye Name: methyl (E)-N-(5-cyano-1H-imidazol-4-yl)benzenecarboximidate CAS Name: (E)-N-(5-cyano-1H-imidazol-4-yl)benzenecarboximidic acid methyl ester IUPAC Name: methyl (E)-N-(5-cyano-1H-imidazol-4-yl)benzenecarboximidate Traditional Name: (E)-N-(5-cyano-1H-imidazol-4-yl)benzenecarboximidic acid methyl ester Formula: C12H10N4O MolecularWeight: 226.234

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Descriptors Computed from Structure

Canonical SMILES:

COC(=NC1=C(NC=N1)C#N)C2=CC=CC=C2

Isomeric SMILES

CO/C(=N/C1=C(NC=N1)C#N)/C2=CC=CC=C2

InChI

InChI=1S/C12H10N4O/c1-17-12(9-5-3-2-4-6-9)16-11-10(7-13)14-8-15-11/h2-6,8H,1H3,(H,14,15)/b16-12+