4-(3-fluorophenyl)-1-(2-hydroxyethylamino)-6-methoxy-isoquinoline-3-carbonitrile

Systemtic Name: 4-(3-fluorophenyl)-1-(2-hydroxyethylamino)-6-methoxy-isoquinoline-3-carbonitrile Openeye Name: 4-(3-fluorophenyl)-1-(2-hydroxyethylamino)-6-methoxy-isoquinoline-3-carbonitrile CAS Name: 4-(3-fluorophenyl)-1-(2-hydroxyethylamino)-6-methoxy-3-isoquinolinecarbonitrile IUPAC Name: 4-(3-fluorophenyl)-1-(2-hydroxyethylamino)-6-methoxyisoquinoline-3-carbonitrile Traditional Name: 4-(3-fluorophenyl)-1-(2-hydroxyethylamino)-6-methoxy-isoquinoline-3-carbonitrile Formula: C19H16FN3O2 MolecularWeight: 337.347643

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=NC(=C2C3=CC(=CC=C3)F)C#N)NCCO

Isomeric SMILES

COC1=CC2=C(C=C1)C(=NC(=C2C3=CC(=CC=C3)F)C#N)NCCO

InChI

InChI=1S/C19H16FN3O2/c1-25-14-5-6-15-16(10-14)18(12-3-2-4-13(20)9-12)17(11-21)23-19(15)22-7-8-24/h2-6,9-10,24H,7-8H2,1H3,(H,22,23)