4-[4-(1H-imidazol-5-ylmethyl)-3-morpholin-4-yl-phenoxy]benzenecarbonitrile

Systemtic Name: 4-[4-(1H-imidazol-5-ylmethyl)-3-morpholin-4-yl-phenoxy]benzenecarbonitrile Openeye Name: 4-[4-(1H-imidazol-5-ylmethyl)-3-morpholino-phenoxy]benzonitrile CAS Name: 4-[4-(1H-imidazol-5-ylmethyl)-3-(4-morpholinyl)phenoxy]benzonitrile IUPAC Name: 4-[4-(1H-imidazol-5-ylmethyl)-3-morpholin-4-ylphenoxy]benzonitrile Traditional Name: 4-[4-(1H-imidazol-5-ylmethyl)-3-morpholino-phenoxy]benzonitrile Formula: C21H20N4O2 MolecularWeight: 360.4091

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=CC(=C2)OC3=CC=C(C=C3)C#N)CC4=CN=CN4

Isomeric SMILES

C1COCCN1C2=C(C=CC(=C2)OC3=CC=C(C=C3)C#N)CC4=CN=CN4

InChI

InChI=1S/C21H20N4O2/c22-13-16-1-4-19(5-2-16)27-20-6-3-17(11-18-14-23-15-24-18)21(12-20)25-7-9-26-10-8-25/h1-6,12,14-15H,7-11H2,(H,23,24)