1-[3-[4-[(3-chloranyl-4-fluoranyl-phenyl)amino]-7-methoxy-quinazolin-6-yl]oxypyrrolidin-1-yl]-2-methoxy-ethanone

Systemtic Name: 1-[3-[4-[(3-chloranyl-4-fluoranyl-phenyl)amino]-7-methoxy-quinazolin-6-yl]oxypyrrolidin-1-yl]-2-methoxy-ethanone Openeye Name: 1-[3-[4-(3-chloro-4-fluoro-anilino)-7-methoxy-quinazolin-6-yl]oxypyrrolidin-1-yl]-2-methoxy-ethanone CAS Name: 1-[3-[[4-(3-chloro-4-fluoroanilino)-7-methoxy-6-quinazolinyl]oxy]-1-pyrrolidinyl]-2-methoxyethanone IUPAC Name: 1-[3-[4-(3-chloro-4-fluoroanilino)-7-methoxyquinazolin-6-yl]oxypyrrolidin-1-yl]-2-methoxyethanone Traditional Name: 1-[3-[4-(3-chloro-4-fluoro-anilino)-7-methoxy-quinazolin-6-yl]oxypyrrolidino]-2-methoxy-ethanone Formula: C22H22ClFN4O4 MolecularWeight: 460.885883

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Descriptors Computed from Structure

Canonical SMILES:

COCC(=O)N1CCC(C1)OC2=C(C=C3C(=C2)C(=NC=N3)NC4=CC(=C(C=C4)F)Cl)OC

Isomeric SMILES

COCC(=O)N1CCC(C1)OC2=C(C=C3C(=C2)C(=NC=N3)NC4=CC(=C(C=C4)F)Cl)OC

InChI

InChI=1S/C22H22ClFN4O4/c1-30-11-21(29)28-6-5-14(10-28)32-20-8-15-18(9-19(20)31-2)25-12-26-22(15)27-13-3-4-17(24)16(23)7-13/h3-4,7-9,12,14H,5-6,10-11H2,1-2H3,(H,25,26,27)