1-[3-[4-[(3-chloranyl-4-fluoranyl-phenyl)amino]-7-methoxy-quinazolin-6-yl]oxypropyl]-4-oxidanyl-pyrrolidine-3-carbonitrile

Systemtic Name: 1-[3-[4-[(3-chloranyl-4-fluoranyl-phenyl)amino]-7-methoxy-quinazolin-6-yl]oxypropyl]-4-oxidanyl-pyrrolidine-3-carbonitrile Openeye Name: 1-[3-[4-(3-chloro-4-fluoro-anilino)-7-methoxy-quinazolin-6-yl]oxypropyl]-4-hydroxy-pyrrolidine-3-carbonitrile CAS Name: 1-[3-[[4-(3-chloro-4-fluoroanilino)-7-methoxy-6-quinazolinyl]oxy]propyl]-4-hydroxy-3-pyrrolidinecarbonitrile IUPAC Name: 1-[3-[4-(3-chloro-4-fluoroanilino)-7-methoxyquinazolin-6-yl]oxypropyl]-4-hydroxypyrrolidine-3-carbonitrile Traditional Name: 1-[3-[4-(3-chloro-4-fluoro-anilino)-7-methoxy-quinazolin-6-yl]oxypropyl]-4-hydroxy-pyrrolidine-3-carbonitrile Formula: C23H23ClFN5O3 MolecularWeight: 471.911823

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)N=CN=C2NC3=CC(=C(C=C3)F)Cl)OCCCN4CC(C(C4)O)C#N

Isomeric SMILES

COC1=C(C=C2C(=C1)N=CN=C2NC3=CC(=C(C=C3)F)Cl)OCCCN4CC(C(C4)O)C#N

InChI

InChI=1S/C23H23ClFN5O3/c1-32-21-9-19-16(23(28-13-27-19)29-15-3-4-18(25)17(24)7-15)8-22(21)33-6-2-5-30-11-14(10-26)20(31)12-30/h3-4,7-9,13-14,20,31H,2,5-6,11-12H2,1H3,(H,27,28,29)