tert-butyl N-(3-chloranyl-4-fluoranyl-phenyl)-N-(7-ethoxy-6-oxidanyl-quinazolin-4-yl)carbamate

Systemtic Name: tert-butyl N-(3-chloranyl-4-fluoranyl-phenyl)-N-(7-ethoxy-6-oxidanyl-quinazolin-4-yl)carbamate Openeye Name: tert-butyl N-(3-chloro-4-fluoro-phenyl)-N-(7-ethoxy-6-hydroxy-quinazolin-4-yl)carbamate CAS Name: N-(3-chloro-4-fluorophenyl)-N-(7-ethoxy-6-hydroxy-4-quinazolinyl)carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-(3-chloro-4-fluorophenyl)-N-(7-ethoxy-6-hydroxyquinazolin-4-yl)carbamate Traditional Name: N-(3-chloro-4-fluoro-phenyl)-N-(7-ethoxy-6-hydroxy-quinazolin-4-yl)carbamic acid tert-butyl ester Formula: C21H21ClFN3O4 MolecularWeight: 433.860543

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)N=CN=C2N(C3=CC(=C(C=C3)F)Cl)C(=O)OC(C)(C)C)O

Isomeric SMILES

CCOC1=C(C=C2C(=C1)N=CN=C2N(C3=CC(=C(C=C3)F)Cl)C(=O)OC(C)(C)C)O

InChI

InChI=1S/C21H21ClFN3O4/c1-5-29-18-10-16-13(9-17(18)27)19(25-11-24-16)26(20(28)30-21(2,3)4)12-6-7-15(23)14(22)8-12/h6-11,27H,5H2,1-4H3