2-(1,3-benzodioxol-5-yl)-3-fluoranyl-7-methoxy-N-pyridin-4-yl-quinolin-4-amine

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-3-fluoranyl-7-methoxy-N-pyridin-4-yl-quinolin-4-amine Openeye Name: 2-(1,3-benzodioxol-5-yl)-3-fluoro-7-methoxy-N-(4-pyridyl)quinolin-4-amine CAS Name: 2-(1,3-benzodioxol-5-yl)-3-fluoro-7-methoxy-N-pyridin-4-yl-4-quinolinamine IUPAC Name: 2-(1,3-benzodioxol-5-yl)-3-fluoro-7-methoxy-N-pyridin-4-ylquinolin-4-amine Traditional Name: [2-(1,3-benzodioxol-5-yl)-3-fluoro-7-methoxy-4-quinolyl]-(4-pyridyl)amine Formula: C22H16FN3O3 MolecularWeight: 389.379143

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=C(C(=N2)C3=CC4=C(C=C3)OCO4)F)NC5=CC=NC=C5

Isomeric SMILES

COC1=CC2=C(C=C1)C(=C(C(=N2)C3=CC4=C(C=C3)OCO4)F)NC5=CC=NC=C5

InChI

InChI=1S/C22H16FN3O3/c1-27-15-3-4-16-17(11-15)26-21(13-2-5-18-19(10-13)29-12-28-18)20(23)22(16)25-14-6-8-24-9-7-14/h2-11H,12H2,1H3,(H,24,25,26)