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

Systemtic Name: 4-[[4-chloranyl-2-(3-methanoylphenyl)phenyl]methoxy-(3-methylimidazol-4-yl)methyl]benzenecarbonitrile Openeye Name: 4-[[4-chloro-2-(3-formylphenyl)phenyl]methoxy-(3-methylimidazol-4-yl)methyl]benzonitrile CAS Name: 4-[[4-chloro-2-(3-formylphenyl)phenyl]methoxy-(3-methyl-4-imidazolyl)methyl]benzonitrile IUPAC Name: 4-[[4-chloro-2-(3-formylphenyl)phenyl]methoxy-(3-methylimidazol-4-yl)methyl]benzonitrile Traditional Name: 4-[[4-chloro-2-(3-formylphenyl)benzyl]oxy-(3-methylimidazol-4-yl)methyl]benzonitrile Formula: C26H20ClN3O2 MolecularWeight: 441.9089

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC=C1C(C2=CC=C(C=C2)C#N)OCC3=C(C=C(C=C3)Cl)C4=CC(=CC=C4)C=O

Isomeric SMILES

CN1C=NC=C1C(C2=CC=C(C=C2)C#N)OCC3=C(C=C(C=C3)Cl)C4=CC(=CC=C4)C=O

InChI

InChI=1S/C26H20ClN3O2/c1-30-17-29-14-25(30)26(20-7-5-18(13-28)6-8-20)32-16-22-9-10-23(27)12-24(22)21-4-2-3-19(11-21)15-31/h2-12,14-15,17,26H,16H2,1H3