1-[2-[4-[(3-chloranyl-4-fluoranyl-phenyl)amino]-7-methoxy-quinazolin-6-yl]oxyethyl-ethyl-amino]propan-2-ol

Systemtic Name: 1-[2-[4-[(3-chloranyl-4-fluoranyl-phenyl)amino]-7-methoxy-quinazolin-6-yl]oxyethyl-ethyl-amino]propan-2-ol Openeye Name: 1-[2-[4-(3-chloro-4-fluoro-anilino)-7-methoxy-quinazolin-6-yl]oxyethyl-ethyl-amino]propan-2-ol CAS Name: 1-[2-[[4-(3-chloro-4-fluoroanilino)-7-methoxy-6-quinazolinyl]oxy]ethyl-ethylamino]-2-propanol IUPAC Name: 1-[2-[4-(3-chloro-4-fluoroanilino)-7-methoxyquinazolin-6-yl]oxyethyl-ethylamino]propan-2-ol Traditional Name: 1-[2-[4-(3-chloro-4-fluoro-anilino)-7-methoxy-quinazolin-6-yl]oxyethyl-ethyl-amino]propan-2-ol Formula: C22H26ClFN4O3 MolecularWeight: 448.918243

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCOC1=C(C=C2C(=C1)C(=NC=N2)NC3=CC(=C(C=C3)F)Cl)OC)CC(C)O

Isomeric SMILES

CCN(CCOC1=C(C=C2C(=C1)C(=NC=N2)NC3=CC(=C(C=C3)F)Cl)OC)CC(C)O

InChI

InChI=1S/C22H26ClFN4O3/c1-4-28(12-14(2)29)7-8-31-21-10-16-19(11-20(21)30-3)25-13-26-22(16)27-15-5-6-18(24)17(23)9-15/h5-6,9-11,13-14,29H,4,7-8,12H2,1-3H3,(H,25,26,27)