tert-butyl 4-[2-[4-[(4-bromanyl-2-fluoranyl-phenyl)amino]-6-methoxy-quinazolin-7-yl]oxyethyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[2-[4-[(4-bromanyl-2-fluoranyl-phenyl)amino]-6-methoxy-quinazolin-7-yl]oxyethyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[2-[4-(4-bromo-2-fluoro-anilino)-6-methoxy-quinazolin-7-yl]oxyethyl]piperidine-1-carboxylate CAS Name: 4-[2-[[4-(4-bromo-2-fluoroanilino)-6-methoxy-7-quinazolinyl]oxy]ethyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[2-[4-(4-bromo-2-fluoroanilino)-6-methoxyquinazolin-7-yl]oxyethyl]piperidine-1-carboxylate Traditional Name: 4-[2-[4-(4-bromo-2-fluoro-anilino)-6-methoxy-quinazolin-7-yl]oxyethyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C27H32BrFN4O4 MolecularWeight: 575.469783

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)CCOC2=C(C=C3C(=C2)N=CN=C3NC4=C(C=C(C=C4)Br)F)OC

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)CCOC2=C(C=C3C(=C2)N=CN=C3NC4=C(C=C(C=C4)Br)F)OC

InChI

InChI=1S/C27H32BrFN4O4/c1-27(2,3)37-26(34)33-10-7-17(8-11-33)9-12-36-24-15-22-19(14-23(24)35-4)25(31-16-30-22)32-21-6-5-18(28)13-20(21)29/h5-6,13-17H,7-12H2,1-4H3,(H,30,31,32)