4-(3-methoxy-4-pyridin-2-yloxy-phenyl)-4-quinolin-3-yl-butan-2-one

Systemtic Name: 4-(3-methoxy-4-pyridin-2-yloxy-phenyl)-4-quinolin-3-yl-butan-2-one Openeye Name: 4-[3-methoxy-4-(2-pyridyloxy)phenyl]-4-(3-quinolyl)butan-2-one CAS Name: 4-[3-methoxy-4-(2-pyridinyloxy)phenyl]-4-(3-quinolinyl)-2-butanone IUPAC Name: 4-(3-methoxy-4-pyridin-2-yloxyphenyl)-4-quinolin-3-ylbutan-2-one Traditional Name: 4-[3-methoxy-4-(2-pyridyloxy)phenyl]-4-(3-quinolyl)butan-2-one Formula: C25H22N2O3 MolecularWeight: 398.45378

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC(C1=CC(=C(C=C1)OC2=CC=CC=N2)OC)C3=CC4=CC=CC=C4N=C3

Isomeric SMILES

CC(=O)CC(C1=CC(=C(C=C1)OC2=CC=CC=N2)OC)C3=CC4=CC=CC=C4N=C3

InChI

InChI=1S/C25H22N2O3/c1-17(28)13-21(20-14-19-7-3-4-8-22(19)27-16-20)18-10-11-23(24(15-18)29-2)30-25-9-5-6-12-26-25/h3-12,14-16,21H,13H2,1-2H3