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

Systemtic Name: (2-chloranyl-7-methoxy-quinolin-3-yl)methyl 4-fluoranyl-3-morpholin-4-ylsulfonyl-benzoate Openeye Name: (2-chloro-7-methoxy-3-quinolyl)methyl 4-fluoro-3-morpholinosulfonyl-benzoate CAS Name: 4-fluoro-3-(4-morpholinylsulfonyl)benzoic acid (2-chloro-7-methoxy-3-quinolinyl)methyl ester IUPAC Name: (2-chloro-7-methoxyquinolin-3-yl)methyl 4-fluoro-3-morpholin-4-ylsulfonylbenzoate Traditional Name: 4-fluoro-3-morpholinosulfonyl-benzoic acid (2-chloro-7-methoxy-3-quinolyl)methyl ester Formula: C22H20ClFN2O6S MolecularWeight: 494.920403

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=NC(=C(C=C2C=C1)COC(=O)C3=CC(=C(C=C3)F)S(=O)(=O)N4CCOCC4)Cl

Isomeric SMILES

COC1=CC2=NC(=C(C=C2C=C1)COC(=O)C3=CC(=C(C=C3)F)S(=O)(=O)N4CCOCC4)Cl

InChI

InChI=1S/C22H20ClFN2O6S/c1-30-17-4-2-14-10-16(21(23)25-19(14)12-17)13-32-22(27)15-3-5-18(24)20(11-15)33(28,29)26-6-8-31-9-7-26/h2-5,10-12H,6-9,13H2,1H3