4-[4-[(4-chloranyl-2-fluoranyl-phenyl)amino]-6-methoxy-quinazolin-7-yl]oxybutanoic acid

Systemtic Name: 4-[4-[(4-chloranyl-2-fluoranyl-phenyl)amino]-6-methoxy-quinazolin-7-yl]oxybutanoic acid Openeye Name: 4-[4-(4-chloro-2-fluoro-anilino)-6-methoxy-quinazolin-7-yl]oxybutanoic acid CAS Name: 4-[[4-(4-chloro-2-fluoroanilino)-6-methoxy-7-quinazolinyl]oxy]butanoic acid IUPAC Name: 4-[4-(4-chloro-2-fluoroanilino)-6-methoxyquinazolin-7-yl]oxybutanoic acid Traditional Name: 4-[4-(4-chloro-2-fluoro-anilino)-6-methoxy-quinazolin-7-yl]oxybutyric acid Formula: C19H17ClFN3O4 MolecularWeight: 405.807383

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC=N2)NC3=C(C=C(C=C3)Cl)F)OCCCC(=O)O

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC=N2)NC3=C(C=C(C=C3)Cl)F)OCCCC(=O)O

InChI

InChI=1S/C19H17ClFN3O4/c1-27-16-8-12-15(9-17(16)28-6-2-3-18(25)26)22-10-23-19(12)24-14-5-4-11(20)7-13(14)21/h4-5,7-10H,2-3,6H2,1H3,(H,25,26)(H,22,23,24)