4-[3-[4-[(3-chloranyl-4-fluoranyl-phenyl)amino]-7-cyclobutyloxy-quinazolin-6-yl]oxypropyl]-5,5-dimethyl-morpholin-2-one

Systemtic Name: 4-[3-[4-[(3-chloranyl-4-fluoranyl-phenyl)amino]-7-cyclobutyloxy-quinazolin-6-yl]oxypropyl]-5,5-dimethyl-morpholin-2-one Openeye Name: 4-[3-[4-(3-chloro-4-fluoro-anilino)-7-(cyclobutoxy)quinazolin-6-yl]oxypropyl]-5,5-dimethyl-morpholin-2-one CAS Name: 4-[3-[[4-(3-chloro-4-fluoroanilino)-7-cyclobutyloxy-6-quinazolinyl]oxy]propyl]-5,5-dimethyl-2-morpholinone IUPAC Name: 4-[3-[4-(3-chloro-4-fluoroanilino)-7-cyclobutyloxyquinazolin-6-yl]oxypropyl]-5,5-dimethylmorpholin-2-one Traditional Name: 4-[3-[4-(3-chloro-4-fluoro-anilino)-7-(cyclobutoxy)quinazolin-6-yl]oxypropyl]-5,5-dimethyl-morpholin-2-one Formula: C27H30ClFN4O4 MolecularWeight: 529.002903

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Descriptors Computed from Structure

Canonical SMILES:

CC1(COC(=O)CN1CCCOC2=C(C=C3C(=C2)C(=NC=N3)NC4=CC(=C(C=C4)F)Cl)OC5CCC5)C

Isomeric SMILES

CC1(COC(=O)CN1CCCOC2=C(C=C3C(=C2)C(=NC=N3)NC4=CC(=C(C=C4)F)Cl)OC5CCC5)C

InChI

InChI=1S/C27H30ClFN4O4/c1-27(2)15-36-25(34)14-33(27)9-4-10-35-23-12-19-22(13-24(23)37-18-5-3-6-18)30-16-31-26(19)32-17-7-8-21(29)20(28)11-17/h7-8,11-13,16,18H,3-6,9-10,14-15H2,1-2H3,(H,30,31,32)