4-[[4-chloranyl-2-(3-methylphenyl)phenyl]methoxy-(3-methylimidazol-4-yl)methyl]benzenecarbonitrile

Systemtic Name: 4-[[4-chloranyl-2-(3-methylphenyl)phenyl]methoxy-(3-methylimidazol-4-yl)methyl]benzenecarbonitrile Openeye Name: 4-[[4-chloro-2-(m-tolyl)phenyl]methoxy-(3-methylimidazol-4-yl)methyl]benzonitrile CAS Name: 4-[[4-chloro-2-(3-methylphenyl)phenyl]methoxy-(3-methyl-4-imidazolyl)methyl]benzonitrile IUPAC Name: 4-[[4-chloro-2-(3-methylphenyl)phenyl]methoxy-(3-methylimidazol-4-yl)methyl]benzonitrile Traditional Name: 4-[[4-chloro-2-(m-tolyl)benzyl]oxy-(3-methylimidazol-4-yl)methyl]benzonitrile Formula: C26H22ClN3O MolecularWeight: 427.92538

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=C(C=CC(=C2)Cl)COC(C3=CC=C(C=C3)C#N)C4=CN=CN4C

Isomeric SMILES

CC1=CC=CC(=C1)C2=C(C=CC(=C2)Cl)COC(C3=CC=C(C=C3)C#N)C4=CN=CN4C

InChI

InChI=1S/C26H22ClN3O/c1-18-4-3-5-21(12-18)24-13-23(27)11-10-22(24)16-31-26(25-15-29-17-30(25)2)20-8-6-19(14-28)7-9-20/h3-13,15,17,26H,16H2,1-2H3