2-chloranyl-4-fluoranyl-5-[(7-phenylmethoxyquinazolin-4-yl)amino]phenol hydrochloride

Systemtic Name: 2-chloranyl-4-fluoranyl-5-[(7-phenylmethoxyquinazolin-4-yl)amino]phenol hydrochloride Openeye Name: 5-[(7-benzyloxyquinazolin-4-yl)amino]-2-chloro-4-fluoro-phenol hydrochloride CAS Name: 2-chloro-4-fluoro-5-[(7-phenylmethoxy-4-quinazolinyl)amino]phenol hydrochloride IUPAC Name: 2-chloro-4-fluoro-5-[(7-phenylmethoxyquinazolin-4-yl)amino]phenol hydrochloride Traditional Name: 5-[(7-benzoxyquinazolin-4-yl)amino]-2-chloro-4-fluoro-phenol hydrochloride Formula: C21H16Cl2FN3O2 MolecularWeight: 432.275043

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC3=C(C=C2)C(=NC=N3)NC4=CC(=C(C=C4F)Cl)O.Cl

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC3=C(C=C2)C(=NC=N3)NC4=CC(=C(C=C4F)Cl)O.Cl

InChI

InChI=1S/C21H15ClFN3O2.ClH/c22-16-9-17(23)19(10-20(16)27)26-21-15-7-6-14(8-18(15)24-12-25-21)28-11-13-4-2-1-3-5-13;/h1-10,12,27H,11H2,(H,24,25,26);1H