N-(3-chloranyl-4-fluoranyl-phenyl)-7-methoxy-6-piperidin-3-yloxy-quinazolin-4-amine dihydrochloride

Systemtic Name: N-(3-chloranyl-4-fluoranyl-phenyl)-7-methoxy-6-piperidin-3-yloxy-quinazolin-4-amine dihydrochloride Openeye Name: N-(3-chloro-4-fluoro-phenyl)-7-methoxy-6-(3-piperidyloxy)quinazolin-4-amine dihydrochloride CAS Name: N-(3-chloro-4-fluorophenyl)-7-methoxy-6-(3-piperidinyloxy)-4-quinazolinamine dihydrochloride IUPAC Name: N-(3-chloro-4-fluorophenyl)-7-methoxy-6-piperidin-3-yloxyquinazolin-4-amine dihydrochloride Traditional Name: (3-chloro-4-fluoro-phenyl)-[7-methoxy-6-(3-piperidyloxy)quinazolin-4-yl]amine dihydrochloride Formula: C20H22Cl3FN4O2 MolecularWeight: 475.771683

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)N=CN=C2NC3=CC(=C(C=C3)F)Cl)OC4CCCNC4.Cl.Cl

Isomeric SMILES

COC1=C(C=C2C(=C1)N=CN=C2NC3=CC(=C(C=C3)F)Cl)OC4CCCNC4.Cl.Cl

InChI

InChI=1S/C20H20ClFN4O2.2ClH/c1-27-18-9-17-14(8-19(18)28-13-3-2-6-23-10-13)20(25-11-24-17)26-12-4-5-16(22)15(21)7-12;;/h4-5,7-9,11,13,23H,2-3,6,10H2,1H3,(H,24,25,26);2*1H