2-[3-(diethylamino)phenoxy]-4-[1-(3-methylimidazol-4-yl)-1-oxidanyl-ethyl]benzenecarbonitrile

Systemtic Name: 2-[3-(diethylamino)phenoxy]-4-[1-(3-methylimidazol-4-yl)-1-oxidanyl-ethyl]benzenecarbonitrile Openeye Name: 2-[3-(diethylamino)phenoxy]-4-[1-hydroxy-1-(3-methylimidazol-4-yl)ethyl]benzonitrile CAS Name: 2-[3-(diethylamino)phenoxy]-4-[1-hydroxy-1-(3-methyl-4-imidazolyl)ethyl]benzonitrile IUPAC Name: 2-[3-(diethylamino)phenoxy]-4-[1-hydroxy-1-(3-methylimidazol-4-yl)ethyl]benzonitrile Traditional Name: 2-[3-(diethylamino)phenoxy]-4-[1-hydroxy-1-(3-methylimidazol-4-yl)ethyl]benzonitrile Formula: C23H26N4O2 MolecularWeight: 390.47814

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC(=CC=C1)OC2=C(C=CC(=C2)C(C)(C3=CN=CN3C)O)C#N

Isomeric SMILES

CCN(CC)C1=CC(=CC=C1)OC2=C(C=CC(=C2)C(C)(C3=CN=CN3C)O)C#N

InChI

InChI=1S/C23H26N4O2/c1-5-27(6-2)19-8-7-9-20(13-19)29-21-12-18(11-10-17(21)14-24)23(3,28)22-15-25-16-26(22)4/h7-13,15-16,28H,5-6H2,1-4H3