1-[4-[(4-bromanyl-2-fluoranyl-phenyl)amino]-6-methoxy-quinazolin-7-yl]oxy-3-piperidin-1-yl-propan-2-ol hydrochloride

Systemtic Name: 1-[4-[(4-bromanyl-2-fluoranyl-phenyl)amino]-6-methoxy-quinazolin-7-yl]oxy-3-piperidin-1-yl-propan-2-ol hydrochloride Openeye Name: 1-[4-(4-bromo-2-fluoro-anilino)-6-methoxy-quinazolin-7-yl]oxy-3-(1-piperidyl)propan-2-ol hydrochloride CAS Name: 1-[[4-(4-bromo-2-fluoroanilino)-6-methoxy-7-quinazolinyl]oxy]-3-(1-piperidinyl)-2-propanol hydrochloride IUPAC Name: 1-[4-(4-bromo-2-fluoroanilino)-6-methoxyquinazolin-7-yl]oxy-3-piperidin-1-ylpropan-2-ol hydrochloride Traditional Name: 1-[4-(4-bromo-2-fluoro-anilino)-6-methoxy-quinazolin-7-yl]oxy-3-piperidino-propan-2-ol hydrochloride Formula: C23H27BrClFN4O3 MolecularWeight: 541.840883

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC=N2)NC3=C(C=C(C=C3)Br)F)OCC(CN4CCCCC4)O.Cl

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC=N2)NC3=C(C=C(C=C3)Br)F)OCC(CN4CCCCC4)O.Cl

InChI

InChI=1S/C23H26BrFN4O3.ClH/c1-31-21-10-17-20(11-22(21)32-13-16(30)12-29-7-3-2-4-8-29)26-14-27-23(17)28-19-6-5-15(24)9-18(19)25;/h5-6,9-11,14,16,30H,2-4,7-8,12-13H2,1H3,(H,26,27,28);1H