1-[4-[4-[(3-chloranyl-4-fluoranyl-phenyl)amino]-7-methoxy-quinazolin-5-yl]oxypiperidin-1-yl]ethanone

Systemtic Name: 1-[4-[4-[(3-chloranyl-4-fluoranyl-phenyl)amino]-7-methoxy-quinazolin-5-yl]oxypiperidin-1-yl]ethanone Openeye Name: 1-[4-[4-(3-chloro-4-fluoro-anilino)-7-methoxy-quinazolin-5-yl]oxy-1-piperidyl]ethanone CAS Name: 1-[4-[[4-(3-chloro-4-fluoroanilino)-7-methoxy-5-quinazolinyl]oxy]-1-piperidinyl]ethanone IUPAC Name: 1-[4-[4-(3-chloro-4-fluoroanilino)-7-methoxyquinazolin-5-yl]oxypiperidin-1-yl]ethanone Traditional Name: 1-[4-[4-(3-chloro-4-fluoro-anilino)-7-methoxy-quinazolin-5-yl]oxypiperidino]ethanone Formula: C22H22ClFN4O3 MolecularWeight: 444.886483

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCC(CC1)OC2=C3C(=CC(=C2)OC)N=CN=C3NC4=CC(=C(C=C4)F)Cl

Isomeric SMILES

CC(=O)N1CCC(CC1)OC2=C3C(=CC(=C2)OC)N=CN=C3NC4=CC(=C(C=C4)F)Cl

InChI

InChI=1S/C22H22ClFN4O3/c1-13(29)28-7-5-15(6-8-28)31-20-11-16(30-2)10-19-21(20)22(26-12-25-19)27-14-3-4-18(24)17(23)9-14/h3-4,9-12,15H,5-8H2,1-2H3,(H,25,26,27)