3-(4-imidazol-1-ylbutoxy)-6-oxidanyl-benzene-1,2-dicarbonitrile hydrochloride

Systemtic Name: 3-(4-imidazol-1-ylbutoxy)-6-oxidanyl-benzene-1,2-dicarbonitrile hydrochloride Openeye Name: 3-hydroxy-6-(4-imidazol-1-ylbutoxy)phthalonitrile hydrochloride CAS Name: 3-hydroxy-6-[4-(1-imidazolyl)butoxy]benzene-1,2-dicarbonitrile hydrochloride IUPAC Name: 3-hydroxy-6-(4-imidazol-1-ylbutoxy)benzene-1,2-dicarbonitrile hydrochloride Traditional Name: 3-hydroxy-6-(4-imidazol-1-ylbutoxy)phthalonitrile hydrochloride Formula: C15H15ClN4O2 MolecularWeight: 318.7582

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1O)C#N)C#N)OCCCCN2C=CN=C2.Cl

Isomeric SMILES

C1=CC(=C(C(=C1O)C#N)C#N)OCCCCN2C=CN=C2.Cl

InChI

InChI=1S/C15H14N4O2.ClH/c16-9-12-13(10-17)15(4-3-14(12)20)21-8-2-1-6-19-7-5-18-11-19;/h3-5,7,11,20H,1-2,6,8H2;1H