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

Systemtic Name: 4-[[4-[(2-fluoranyl-4-methyl-5-oxidanyl-phenyl)amino]-6-methoxy-quinazolin-2-yl]oxymethyl]benzenecarbonitrile hydrochloride Openeye Name: 4-[[4-(2-fluoro-5-hydroxy-4-methyl-anilino)-6-methoxy-quinazolin-2-yl]oxymethyl]benzonitrile hydrochloride CAS Name: 4-[[4-(2-fluoro-5-hydroxy-4-methylanilino)-6-methoxy-2-quinazolinyl]oxymethyl]benzonitrile hydrochloride IUPAC Name: 4-[[4-(2-fluoro-5-hydroxy-4-methylanilino)-6-methoxyquinazolin-2-yl]oxymethyl]benzonitrile hydrochloride Traditional Name: 4-[[4-(2-fluoro-5-hydroxy-4-methyl-anilino)-6-methoxy-quinazolin-2-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=C2C=C(C=C3)OC)OCC4=CC=C(C=C4)C#N)F.Cl

Isomeric SMILES

CC1=CC(=C(C=C1O)NC2=NC(=NC3=C2C=C(C=C3)OC)OCC4=CC=C(C=C4)C#N)F.Cl

InChI

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