2-[4-[4-(1,3-benzodioxol-5-yl)-5-pyridin-2-yl-1H-imidazol-2-yl]phenoxy]ethanenitrile

Systemtic Name: 2-[4-[4-(1,3-benzodioxol-5-yl)-5-pyridin-2-yl-1H-imidazol-2-yl]phenoxy]ethanenitrile Openeye Name: 2-[4-[4-(1,3-benzodioxol-5-yl)-5-(2-pyridyl)-1H-imidazol-2-yl]phenoxy]acetonitrile CAS Name: 2-[4-[4-(1,3-benzodioxol-5-yl)-5-(2-pyridinyl)-1H-imidazol-2-yl]phenoxy]acetonitrile IUPAC Name: 2-[4-[4-(1,3-benzodioxol-5-yl)-5-pyridin-2-yl-1H-imidazol-2-yl]phenoxy]acetonitrile Traditional Name: 2-[4-[4-(1,3-benzodioxol-5-yl)-5-(2-pyridyl)-1H-imidazol-2-yl]phenoxy]acetonitrile Formula: C23H16N4O3 MolecularWeight: 396.39814

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C3=C(NC(=N3)C4=CC=C(C=C4)OCC#N)C5=CC=CC=N5

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C3=C(NC(=N3)C4=CC=C(C=C4)OCC#N)C5=CC=CC=N5

InChI

InChI=1S/C23H16N4O3/c24-10-12-28-17-7-4-15(5-8-17)23-26-21(22(27-23)18-3-1-2-11-25-18)16-6-9-19-20(13-16)30-14-29-19/h1-9,11,13H,12,14H2,(H,26,27)