[1-[2,6-bis(chloranyl)phenyl]-5-[2,4-bis(fluoranyl)phenyl]-2-oxidanylidene-quinolin-7-yl] tris(fluoranyl)methanesulfonate

Systemtic Name: [1-[2,6-bis(chloranyl)phenyl]-5-[2,4-bis(fluoranyl)phenyl]-2-oxidanylidene-quinolin-7-yl] tris(fluoranyl)methanesulfonate Openeye Name: [1-(2,6-dichlorophenyl)-5-(2,4-difluorophenyl)-2-oxo-7-quinolyl] trifluoromethanesulfonate CAS Name: trifluoromethanesulfonic acid [1-(2,6-dichlorophenyl)-5-(2,4-difluorophenyl)-2-oxo-7-quinolinyl] ester IUPAC Name: [1-(2,6-dichlorophenyl)-5-(2,4-difluorophenyl)-2-oxoquinolin-7-yl] trifluoromethanesulfonate Traditional Name: trifluoromethanesulfonic acid [1-(2,6-dichlorophenyl)-5-(2,4-difluorophenyl)-2-keto-7-quinolyl] ester Formula: C22H10Cl2F5NO4S MolecularWeight: 550.282116

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)Cl)N2C(=O)C=CC3=C2C=C(C=C3C4=C(C=C(C=C4)F)F)OS(=O)(=O)C(F)(F)F)Cl

Isomeric SMILES

C1=CC(=C(C(=C1)Cl)N2C(=O)C=CC3=C2C=C(C=C3C4=C(C=C(C=C4)F)F)OS(=O)(=O)C(F)(F)F)Cl

InChI

InChI=1S/C22H10Cl2F5NO4S/c23-16-2-1-3-17(24)21(16)30-19-10-12(34-35(32,33)22(27,28)29)9-15(14(19)6-7-20(30)31)13-5-4-11(25)8-18(13)26/h1-10H