2-(3-chloranylphenoxy)-5-[(4-phenylimidazol-1-yl)methyl]benzenecarbonitrile hydrochloride

Systemtic Name: 2-(3-chloranylphenoxy)-5-[(4-phenylimidazol-1-yl)methyl]benzenecarbonitrile hydrochloride Openeye Name: 2-(3-chlorophenoxy)-5-[(4-phenylimidazol-1-yl)methyl]benzonitrile hydrochloride CAS Name: 2-(3-chlorophenoxy)-5-[(4-phenyl-1-imidazolyl)methyl]benzonitrile hydrochloride IUPAC Name: 2-(3-chlorophenoxy)-5-[(4-phenylimidazol-1-yl)methyl]benzonitrile hydrochloride Traditional Name: 2-(3-chlorophenoxy)-5-[(4-phenylimidazol-1-yl)methyl]benzonitrile hydrochloride Formula: C23H17Cl2N3O MolecularWeight: 422.30658

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CN(C=N2)CC3=CC(=C(C=C3)OC4=CC(=CC=C4)Cl)C#N.Cl

Isomeric SMILES

C1=CC=C(C=C1)C2=CN(C=N2)CC3=CC(=C(C=C3)OC4=CC(=CC=C4)Cl)C#N.Cl

InChI

InChI=1S/C23H16ClN3O.ClH/c24-20-7-4-8-21(12-20)28-23-10-9-17(11-19(23)13-25)14-27-15-22(26-16-27)18-5-2-1-3-6-18;/h1-12,15-16H,14H2;1H