(2-chloranyl-7-methoxy-quinolin-3-yl)methyl 3-(diethylsulfamoyl)-4-fluoranyl-benzoate

Systemtic Name: (2-chloranyl-7-methoxy-quinolin-3-yl)methyl 3-(diethylsulfamoyl)-4-fluoranyl-benzoate Openeye Name: (2-chloro-7-methoxy-3-quinolyl)methyl 3-(diethylsulfamoyl)-4-fluoro-benzoate CAS Name: 3-(diethylsulfamoyl)-4-fluorobenzoic acid (2-chloro-7-methoxy-3-quinolinyl)methyl ester IUPAC Name: (2-chloro-7-methoxyquinolin-3-yl)methyl 3-(diethylsulfamoyl)-4-fluorobenzoate Traditional Name: 3-(diethylsulfamoyl)-4-fluoro-benzoic acid (2-chloro-7-methoxy-3-quinolyl)methyl ester Formula: C22H22ClFN2O5S MolecularWeight: 480.936883

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=C(C=CC(=C1)C(=O)OCC2=C(N=C3C=C(C=CC3=C2)OC)Cl)F

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=C(C=CC(=C1)C(=O)OCC2=C(N=C3C=C(C=CC3=C2)OC)Cl)F

InChI

InChI=1S/C22H22ClFN2O5S/c1-4-26(5-2)32(28,29)20-11-15(7-9-18(20)24)22(27)31-13-16-10-14-6-8-17(30-3)12-19(14)25-21(16)23/h6-12H,4-5,13H2,1-3H3