3-[[6-[(6-fluoranylquinolin-2-yl)methoxy]-4-oxidanyl-3,4-dihydro-2H-chromen-3-yl]methyl]-N-methylsulfonyl-benzamide

Systemtic Name: 3-[[6-[(6-fluoranylquinolin-2-yl)methoxy]-4-oxidanyl-3,4-dihydro-2H-chromen-3-yl]methyl]-N-methylsulfonyl-benzamide Openeye Name: 3-[[6-[(6-fluoro-2-quinolyl)methoxy]-4-hydroxy-chroman-3-yl]methyl]-N-methylsulfonyl-benzamide CAS Name: 3-[[6-[(6-fluoro-2-quinolinyl)methoxy]-4-hydroxy-3,4-dihydro-2H-1-benzopyran-3-yl]methyl]-N-methylsulfonylbenzamide IUPAC Name: 3-[[6-[(6-fluoroquinolin-2-yl)methoxy]-4-hydroxy-3,4-dihydro-2H-chromen-3-yl]methyl]-N-methylsulfonylbenzamide Traditional Name: 3-[[6-[(6-fluoro-2-quinolyl)methoxy]-4-hydroxy-chroman-3-yl]methyl]-N-mesyl-benzamide Formula: C28H25FN2O6S MolecularWeight: 536.571303

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC(=O)C1=CC(=CC=C1)CC2COC3=C(C2O)C=C(C=C3)OCC4=NC5=C(C=C4)C=C(C=C5)F

Isomeric SMILES

CS(=O)(=O)NC(=O)C1=CC(=CC=C1)CC2COC3=C(C2O)C=C(C=C3)OCC4=NC5=C(C=C4)C=C(C=C5)F

InChI

InChI=1S/C28H25FN2O6S/c1-38(34,35)31-28(33)19-4-2-3-17(11-19)12-20-15-37-26-10-8-23(14-24(26)27(20)32)36-16-22-7-5-18-13-21(29)6-9-25(18)30-22/h2-11,13-14,20,27,32H,12,15-16H2,1H3,(H,31,33)