(3-chloranyl-4-methyl-quinolin-2-yl)methyl 2-morpholin-4-yl-5-sulfamoyl-benzoate

Systemtic Name: (3-chloranyl-4-methyl-quinolin-2-yl)methyl 2-morpholin-4-yl-5-sulfamoyl-benzoate Openeye Name: (3-chloro-4-methyl-2-quinolyl)methyl 2-morpholino-5-sulfamoyl-benzoate CAS Name: 2-(4-morpholinyl)-5-sulfamoylbenzoic acid (3-chloro-4-methyl-2-quinolinyl)methyl ester IUPAC Name: (3-chloro-4-methylquinolin-2-yl)methyl 2-morpholin-4-yl-5-sulfamoylbenzoate Traditional Name: 2-morpholino-5-sulfamoyl-benzoic acid (3-chloro-4-methyl-2-quinolyl)methyl ester Formula: C22H22ClN3O5S MolecularWeight: 475.94518

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC2=CC=CC=C12)COC(=O)C3=C(C=CC(=C3)S(=O)(=O)N)N4CCOCC4)Cl

Isomeric SMILES

CC1=C(C(=NC2=CC=CC=C12)COC(=O)C3=C(C=CC(=C3)S(=O)(=O)N)N4CCOCC4)Cl

InChI

InChI=1S/C22H22ClN3O5S/c1-14-16-4-2-3-5-18(16)25-19(21(14)23)13-31-22(27)17-12-15(32(24,28)29)6-7-20(17)26-8-10-30-11-9-26/h2-7,12H,8-11,13H2,1H3,(H2,24,28,29)