[5-chloranyl-6-(oxan-4-yloxy)-1,3-dihydroisoindol-2-yl]-[5-methylsulfonyl-2-[2,2,3,3,3-pentakis(fluoranyl)propoxy]phenyl]methanone

Systemtic Name: [5-chloranyl-6-(oxan-4-yloxy)-1,3-dihydroisoindol-2-yl]-[5-methylsulfonyl-2-[2,2,3,3,3-pentakis(fluoranyl)propoxy]phenyl]methanone Openeye Name: (5-chloro-6-tetrahydropyran-4-yloxy-isoindolin-2-yl)-[5-methylsulfonyl-2-(2,2,3,3,3-pentafluoropropoxy)phenyl]methanone CAS Name: [5-chloro-6-(4-oxanyloxy)-1,3-dihydroisoindol-2-yl]-[5-methylsulfonyl-2-(2,2,3,3,3-pentafluoropropoxy)phenyl]methanone IUPAC Name: [5-chloro-6-(oxan-4-yloxy)-1,3-dihydroisoindol-2-yl]-[5-methylsulfonyl-2-(2,2,3,3,3-pentafluoropropoxy)phenyl]methanone Traditional Name: (5-chloro-6-tetrahydropyran-4-yloxy-isoindolin-2-yl)-[5-mesyl-2-(2,2,3,3,3-pentafluoropropoxy)phenyl]methanone Formula: C24H23ClF5NO6S MolecularWeight: 583.952536

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)OCC(C(F)(F)F)(F)F)C(=O)N2CC3=CC(=C(C=C3C2)Cl)OC4CCOCC4

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)OCC(C(F)(F)F)(F)F)C(=O)N2CC3=CC(=C(C=C3C2)Cl)OC4CCOCC4

InChI

InChI=1S/C24H23ClF5NO6S/c1-38(33,34)17-2-3-20(36-13-23(26,27)24(28,29)30)18(10-17)22(32)31-11-14-8-19(25)21(9-15(14)12-31)37-16-4-6-35-7-5-16/h2-3,8-10,16H,4-7,11-13H2,1H3