4-(8-azanylisoquinolin-5-yl)oxybenzenecarbonitrile

Systemtic Name: 4-(8-azanylisoquinolin-5-yl)oxybenzenecarbonitrile Openeye Name: 4-[(8-amino-5-isoquinolyl)oxy]benzonitrile CAS Name: 4-[(8-amino-5-isoquinolinyl)oxy]benzonitrile IUPAC Name: 4-(8-aminoisoquinolin-5-yl)oxybenzonitrile Traditional Name: 4-[(8-amino-5-isoquinolyl)oxy]benzonitrile Formula: C16H11N3O MolecularWeight: 261.27804

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#N)OC2=C3C=CN=CC3=C(C=C2)N

Isomeric SMILES

C1=CC(=CC=C1C#N)OC2=C3C=CN=CC3=C(C=C2)N

InChI

InChI=1S/C16H11N3O/c17-9-11-1-3-12(4-2-11)20-16-6-5-15(18)14-10-19-8-7-13(14)16/h1-8,10H,18H2