4-[[4-[(2-fluoranyl-4-methyl-5-oxidanyl-phenyl)amino]-6-methoxy-quinazolin-7-yl]oxymethyl]benzenecarbonitrile hydrochloride

Systemtic Name: 4-[[4-[(2-fluoranyl-4-methyl-5-oxidanyl-phenyl)amino]-6-methoxy-quinazolin-7-yl]oxymethyl]benzenecarbonitrile hydrochloride Openeye Name: 4-[[4-(2-fluoro-5-hydroxy-4-methyl-anilino)-6-methoxy-quinazolin-7-yl]oxymethyl]benzonitrile hydrochloride CAS Name: 4-[[4-(2-fluoro-5-hydroxy-4-methylanilino)-6-methoxy-7-quinazolinyl]oxymethyl]benzonitrile hydrochloride IUPAC Name: 4-[[4-(2-fluoro-5-hydroxy-4-methylanilino)-6-methoxyquinazolin-7-yl]oxymethyl]benzonitrile hydrochloride Traditional Name: 4-[[4-(2-fluoro-5-hydroxy-4-methyl-anilino)-6-methoxy-quinazolin-7-yl]oxymethyl]benzonitrile hydrochloride Formula: C24H20ClFN4O3 MolecularWeight: 466.892003

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1O)NC2=NC=NC3=CC(=C(C=C32)OC)OCC4=CC=C(C=C4)C#N)F.Cl

Isomeric SMILES

CC1=CC(=C(C=C1O)NC2=NC=NC3=CC(=C(C=C32)OC)OCC4=CC=C(C=C4)C#N)F.Cl

InChI

InChI=1S/C24H19FN4O3.ClH/c1-14-7-18(25)20(9-21(14)30)29-24-17-8-22(31-2)23(10-19(17)27-13-28-24)32-12-16-5-3-15(11-26)4-6-16;/h3-10,13,30H,12H2,1-2H3,(H,27,28,29);1H