4-[[(4-cyanophenyl)-(3-methylimidazol-4-yl)methoxy]methyl]-3-(3,3-dimethylbutyl)benzenecarbonitrile

Systemtic Name: 4-[[(4-cyanophenyl)-(3-methylimidazol-4-yl)methoxy]methyl]-3-(3,3-dimethylbutyl)benzenecarbonitrile Openeye Name: 4-[[(4-cyanophenyl)-(3-methylimidazol-4-yl)methoxy]methyl]-3-(3,3-dimethylbutyl)benzonitrile CAS Name: 4-[[(4-cyanophenyl)-(3-methyl-4-imidazolyl)methoxy]methyl]-3-(3,3-dimethylbutyl)benzonitrile IUPAC Name: 4-[[(4-cyanophenyl)-(3-methylimidazol-4-yl)methoxy]methyl]-3-(3,3-dimethylbutyl)benzonitrile Traditional Name: 4-[[(4-cyanophenyl)-(3-methylimidazol-4-yl)methoxy]methyl]-3-(3,3-dimethylbutyl)benzonitrile Formula: C26H28N4O MolecularWeight: 412.52672

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CCC1=C(C=CC(=C1)C#N)COC(C2=CC=C(C=C2)C#N)C3=CN=CN3C

Isomeric SMILES

CC(C)(C)CCC1=C(C=CC(=C1)C#N)COC(C2=CC=C(C=C2)C#N)C3=CN=CN3C

InChI

InChI=1S/C26H28N4O/c1-26(2,3)12-11-22-13-20(15-28)7-10-23(22)17-31-25(24-16-29-18-30(24)4)21-8-5-19(14-27)6-9-21/h5-10,13,16,18,25H,11-12,17H2,1-4H3