1-[4-[[4-[(4-chloranyl-2-fluoranyl-phenyl)amino]-6-methoxy-quinazolin-7-yl]oxymethyl]piperidin-1-yl]-2-morpholin-4-yl-ethanone

Systemtic Name: 1-[4-[[4-[(4-chloranyl-2-fluoranyl-phenyl)amino]-6-methoxy-quinazolin-7-yl]oxymethyl]piperidin-1-yl]-2-morpholin-4-yl-ethanone Openeye Name: 1-[4-[[4-(4-chloro-2-fluoro-anilino)-6-methoxy-quinazolin-7-yl]oxymethyl]-1-piperidyl]-2-morpholino-ethanone CAS Name: 1-[4-[[4-(4-chloro-2-fluoroanilino)-6-methoxy-7-quinazolinyl]oxymethyl]-1-piperidinyl]-2-(4-morpholinyl)ethanone IUPAC Name: 1-[4-[[4-(4-chloro-2-fluoroanilino)-6-methoxyquinazolin-7-yl]oxymethyl]piperidin-1-yl]-2-morpholin-4-ylethanone Traditional Name: 1-[4-[[4-(4-chloro-2-fluoro-anilino)-6-methoxy-quinazolin-7-yl]oxymethyl]piperidino]-2-morpholino-ethanone Formula: C27H31ClFN5O4 MolecularWeight: 544.017543

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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)OCC4CCN(CC4)C(=O)CN5CCOCC5

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC=N2)NC3=C(C=C(C=C3)Cl)F)OCC4CCN(CC4)C(=O)CN5CCOCC5

InChI

InChI=1S/C27H31ClFN5O4/c1-36-24-13-20-23(30-17-31-27(20)32-22-3-2-19(28)12-21(22)29)14-25(24)38-16-18-4-6-34(7-5-18)26(35)15-33-8-10-37-11-9-33/h2-3,12-14,17-18H,4-11,15-16H2,1H3,(H,30,31,32)