[4-[4-[(3-chloranyl-4-fluoranyl-phenyl)amino]-7-methoxy-quinazolin-6-yl]oxypiperidin-1-yl]-piperidin-1-yl-methanone

Systemtic Name: [4-[4-[(3-chloranyl-4-fluoranyl-phenyl)amino]-7-methoxy-quinazolin-6-yl]oxypiperidin-1-yl]-piperidin-1-yl-methanone Openeye Name: [4-[4-(3-chloro-4-fluoro-anilino)-7-methoxy-quinazolin-6-yl]oxy-1-piperidyl]-(1-piperidyl)methanone CAS Name: [4-[[4-(3-chloro-4-fluoroanilino)-7-methoxy-6-quinazolinyl]oxy]-1-piperidinyl]-(1-piperidinyl)methanone IUPAC Name: [4-[4-(3-chloro-4-fluoroanilino)-7-methoxyquinazolin-6-yl]oxypiperidin-1-yl]-piperidin-1-ylmethanone Traditional Name: [4-[4-(3-chloro-4-fluoro-anilino)-7-methoxy-quinazolin-6-yl]oxypiperidino]-piperidino-methanone Formula: C26H29ClFN5O3 MolecularWeight: 513.991563

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)N=CN=C2NC3=CC(=C(C=C3)F)Cl)OC4CCN(CC4)C(=O)N5CCCCC5

Isomeric SMILES

COC1=C(C=C2C(=C1)N=CN=C2NC3=CC(=C(C=C3)F)Cl)OC4CCN(CC4)C(=O)N5CCCCC5

InChI

InChI=1S/C26H29ClFN5O3/c1-35-23-15-22-19(25(30-16-29-22)31-17-5-6-21(28)20(27)13-17)14-24(23)36-18-7-11-33(12-8-18)26(34)32-9-3-2-4-10-32/h5-6,13-16,18H,2-4,7-12H2,1H3,(H,29,30,31)