N-(4-chloranyl-2-fluoranyl-phenyl)-6-methoxy-7-phenylmethoxy-quinazolin-4-amine hydrochloride

Systemtic Name: N-(4-chloranyl-2-fluoranyl-phenyl)-6-methoxy-7-phenylmethoxy-quinazolin-4-amine hydrochloride Openeye Name: 7-benzyloxy-N-(4-chloro-2-fluoro-phenyl)-6-methoxy-quinazolin-4-amine hydrochloride CAS Name: N-(4-chloro-2-fluorophenyl)-6-methoxy-7-phenylmethoxy-4-quinazolinamine hydrochloride IUPAC Name: N-(4-chloro-2-fluorophenyl)-6-methoxy-7-phenylmethoxyquinazolin-4-amine hydrochloride Traditional Name: (7-benzoxy-6-methoxy-quinazolin-4-yl)-(4-chloro-2-fluoro-phenyl)amine hydrochloride Formula: C22H18Cl2FN3O2 MolecularWeight: 446.301623

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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)OCC4=CC=CC=C4.Cl

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC=N2)NC3=C(C=C(C=C3)Cl)F)OCC4=CC=CC=C4.Cl

InChI

InChI=1S/C22H17ClFN3O2.ClH/c1-28-20-10-16-19(11-21(20)29-12-14-5-3-2-4-6-14)25-13-26-22(16)27-18-8-7-15(23)9-17(18)24;/h2-11,13H,12H2,1H3,(H,25,26,27);1H