methyl (1E)-N-(5-cyano-3-ethyl-imidazol-4-yl)heptanimidate

Systemtic Name: methyl (1E)-N-(5-cyano-3-ethyl-imidazol-4-yl)heptanimidate Openeye Name: methyl (1E)-N-(5-cyano-3-ethyl-imidazol-4-yl)heptanimidate CAS Name: (1E)-N-(5-cyano-3-ethyl-4-imidazolyl)heptanimidic acid methyl ester IUPAC Name: methyl (1E)-N-(5-cyano-3-ethylimidazol-4-yl)heptanimidate Traditional Name: (1E)-N-(5-cyano-3-ethyl-imidazol-4-yl)enanthimidic acid methyl ester Formula: C14H22N4O MolecularWeight: 262.35068

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=NC1=C(N=CN1CC)C#N)OC

Isomeric SMILES

CCCCCC/C(=N\C1=C(N=CN1CC)C#N)/OC

InChI

InChI=1S/C14H22N4O/c1-4-6-7-8-9-13(19-3)17-14-12(10-15)16-11-18(14)5-2/h11H,4-9H2,1-3H3/b17-13+