4-(2,3-dihydro-1,4-benzodioxin-6-ylmethylamino)-N-(8-fluoranyl-6-methoxy-quinolin-4-yl)cyclohexane-1-carboxamide

Systemtic Name: 4-(2,3-dihydro-1,4-benzodioxin-6-ylmethylamino)-N-(8-fluoranyl-6-methoxy-quinolin-4-yl)cyclohexane-1-carboxamide Openeye Name: 4-(2,3-dihydro-1,4-benzodioxin-6-ylmethylamino)-N-(8-fluoro-6-methoxy-4-quinolyl)cyclohexanecarboxamide CAS Name: 4-(2,3-dihydro-1,4-benzodioxin-6-ylmethylamino)-N-(8-fluoro-6-methoxy-4-quinolinyl)-1-cyclohexanecarboxamide IUPAC Name: 4-(2,3-dihydro-1,4-benzodioxin-6-ylmethylamino)-N-(8-fluoro-6-methoxyquinolin-4-yl)cyclohexane-1-carboxamide Traditional Name: 4-(2,3-dihydro-1,4-benzodioxin-6-ylmethylamino)-N-(8-fluoro-6-methoxy-4-quinolyl)cyclohexanecarboxamide Formula: C26H28FN3O4 MolecularWeight: 465.516623

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=CN=C2C(=C1)F)NC(=O)C3CCC(CC3)NCC4=CC5=C(C=C4)OCCO5

Isomeric SMILES

COC1=CC2=C(C=CN=C2C(=C1)F)NC(=O)C3CCC(CC3)NCC4=CC5=C(C=C4)OCCO5

InChI

InChI=1S/C26H28FN3O4/c1-32-19-13-20-22(8-9-28-25(20)21(27)14-19)30-26(31)17-3-5-18(6-4-17)29-15-16-2-7-23-24(12-16)34-11-10-33-23/h2,7-9,12-14,17-18,29H,3-6,10-11,15H2,1H3,(H,28,30,31)