3-[[4-bromanyl-2-fluoranyl-6-methoxy-7-(2-oxidanyl-3-pyrrolidin-1-yl-propoxy)quinazolin-5-yl]amino]phenol

Systemtic Name: 3-[[4-bromanyl-2-fluoranyl-6-methoxy-7-(2-oxidanyl-3-pyrrolidin-1-yl-propoxy)quinazolin-5-yl]amino]phenol Openeye Name: 3-[[4-bromo-2-fluoro-7-(2-hydroxy-3-pyrrolidin-1-yl-propoxy)-6-methoxy-quinazolin-5-yl]amino]phenol CAS Name: 3-[[4-bromo-2-fluoro-7-[2-hydroxy-3-(1-pyrrolidinyl)propoxy]-6-methoxy-5-quinazolinyl]amino]phenol IUPAC Name: 3-[[4-bromo-2-fluoro-7-(2-hydroxy-3-pyrrolidin-1-ylpropoxy)-6-methoxyquinazolin-5-yl]amino]phenol Traditional Name: 3-[[4-bromo-2-fluoro-7-(2-hydroxy-3-pyrrolidino-propoxy)-6-methoxy-quinazolin-5-yl]amino]phenol Formula: C22H24BrFN4O4 MolecularWeight: 507.352763

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1NC3=CC(=CC=C3)O)C(=NC(=N2)F)Br)OCC(CN4CCCC4)O

Isomeric SMILES

COC1=C(C=C2C(=C1NC3=CC(=CC=C3)O)C(=NC(=N2)F)Br)OCC(CN4CCCC4)O

InChI

InChI=1S/C22H24BrFN4O4/c1-31-20-17(32-12-15(30)11-28-7-2-3-8-28)10-16-18(21(23)27-22(24)26-16)19(20)25-13-5-4-6-14(29)9-13/h4-6,9-10,15,25,29-30H,2-3,7-8,11-12H2,1H3