(2E)-2-(imidazol-1-ylmethylidene)-4-oxidanylidene-hexanenitrile

Systemtic Name: (2E)-2-(imidazol-1-ylmethylidene)-4-oxidanylidene-hexanenitrile Openeye Name: (2E)-2-(imidazol-1-ylmethylene)-4-oxo-hexanenitrile CAS Name: (2E)-2-(1-imidazolylmethylidene)-4-oxohexanenitrile IUPAC Name: (2E)-2-(imidazol-1-ylmethylidene)-4-oxohexanenitrile Traditional Name: (E)-3-imidazol-1-yl-2-(2-ketobutyl)acrylonitrile Formula: C10H11N3O MolecularWeight: 189.21384

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)CC(=CN1C=CN=C1)C#N

Isomeric SMILES

CCC(=O)C/C(=C\N1C=CN=C1)/C#N

InChI

InChI=1S/C10H11N3O/c1-2-10(14)5-9(6-11)7-13-4-3-12-8-13/h3-4,7-8H,2,5H2,1H3/b9-7+