3-bromanyl-4-[2-(4-cyanophenyl)-2-(3-methylimidazol-4-yl)-2-oxidanyl-ethoxy]benzenecarbonitrile

Systemtic Name: 3-bromanyl-4-[2-(4-cyanophenyl)-2-(3-methylimidazol-4-yl)-2-oxidanyl-ethoxy]benzenecarbonitrile Openeye Name: 3-bromo-4-[2-(4-cyanophenyl)-2-hydroxy-2-(3-methylimidazol-4-yl)ethoxy]benzonitrile CAS Name: 3-bromo-4-[2-(4-cyanophenyl)-2-hydroxy-2-(3-methyl-4-imidazolyl)ethoxy]benzonitrile IUPAC Name: 3-bromo-4-[2-(4-cyanophenyl)-2-hydroxy-2-(3-methylimidazol-4-yl)ethoxy]benzonitrile Traditional Name: 3-bromo-4-[2-(4-cyanophenyl)-2-hydroxy-2-(3-methylimidazol-4-yl)ethoxy]benzonitrile Formula: C20H15BrN4O2 MolecularWeight: 423.2627

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC=C1C(COC2=C(C=C(C=C2)C#N)Br)(C3=CC=C(C=C3)C#N)O

Isomeric SMILES

CN1C=NC=C1C(COC2=C(C=C(C=C2)C#N)Br)(C3=CC=C(C=C3)C#N)O

InChI

InChI=1S/C20H15BrN4O2/c1-25-13-24-11-19(25)20(26,16-5-2-14(9-22)3-6-16)12-27-18-7-4-15(10-23)8-17(18)21/h2-8,11,13,26H,12H2,1H3