(2-chloranyl-7-methyl-quinolin-3-yl)methyl 2-fluoranyl-5-morpholin-4-ylsulfonyl-benzoate

Systemtic Name: (2-chloranyl-7-methyl-quinolin-3-yl)methyl 2-fluoranyl-5-morpholin-4-ylsulfonyl-benzoate Openeye Name: (2-chloro-7-methyl-3-quinolyl)methyl 2-fluoro-5-morpholinosulfonyl-benzoate CAS Name: 2-fluoro-5-(4-morpholinylsulfonyl)benzoic acid (2-chloro-7-methyl-3-quinolinyl)methyl ester IUPAC Name: (2-chloro-7-methylquinolin-3-yl)methyl 2-fluoro-5-morpholin-4-ylsulfonylbenzoate Traditional Name: 2-fluoro-5-morpholinosulfonyl-benzoic acid (2-chloro-7-methyl-3-quinolyl)methyl ester Formula: C22H20ClFN2O5S MolecularWeight: 478.921003

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=NC(=C(C=C2C=C1)COC(=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCOCC4)F)Cl

Isomeric SMILES

CC1=CC2=NC(=C(C=C2C=C1)COC(=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCOCC4)F)Cl

InChI

InChI=1S/C22H20ClFN2O5S/c1-14-2-3-15-11-16(21(23)25-20(15)10-14)13-31-22(27)18-12-17(4-5-19(18)24)32(28,29)26-6-8-30-9-7-26/h2-5,10-12H,6-9,13H2,1H3