tert-butyl (E)-3-[4-(4-chloranyl-2-fluoranyl-phenoxy)-6-methoxy-quinazolin-7-yl]prop-2-enoate

Systemtic Name: tert-butyl (E)-3-[4-(4-chloranyl-2-fluoranyl-phenoxy)-6-methoxy-quinazolin-7-yl]prop-2-enoate Openeye Name: tert-butyl (E)-3-[4-(4-chloro-2-fluoro-phenoxy)-6-methoxy-quinazolin-7-yl]prop-2-enoate CAS Name: (E)-3-[4-(4-chloro-2-fluorophenoxy)-6-methoxy-7-quinazolinyl]-2-propenoic acid tert-butyl ester IUPAC Name: tert-butyl (E)-3-[4-(4-chloro-2-fluorophenoxy)-6-methoxyquinazolin-7-yl]prop-2-enoate Traditional Name: (E)-3-[4-(4-chloro-2-fluoro-phenoxy)-6-methoxy-quinazolin-7-yl]acrylic acid tert-butyl ester Formula: C22H20ClFN2O4 MolecularWeight: 430.856603

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C=CC1=C(C=C2C(=C1)N=CN=C2OC3=C(C=C(C=C3)Cl)F)OC

Isomeric SMILES

CC(C)(C)OC(=O)/C=C/C1=C(C=C2C(=C1)N=CN=C2OC3=C(C=C(C=C3)Cl)F)OC

InChI

InChI=1S/C22H20ClFN2O4/c1-22(2,3)30-20(27)8-5-13-9-17-15(11-19(13)28-4)21(26-12-25-17)29-18-7-6-14(23)10-16(18)24/h5-12H,1-4H3/b8-5+