methyl 3-[(5,7-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl-(2-hydroxyethyl)sulfamoyl]benzoate

Systemtic Name: methyl 3-[(5,7-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl-(2-hydroxyethyl)sulfamoyl]benzoate Openeye Name: methyl 3-[(5,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl-(2-hydroxyethyl)sulfamoyl]benzoate CAS Name: 3-[(5,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl-(2-hydroxyethyl)sulfamoyl]benzoic acid methyl ester IUPAC Name: methyl 3-[(5,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl-(2-hydroxyethyl)sulfamoyl]benzoate Traditional Name: 3-[2-hydroxyethyl-[(2-keto-5,7-dimethyl-1H-quinolin-3-yl)methyl]sulfamoyl]benzoic acid methyl ester Formula: C22H24N2O6S MolecularWeight: 444.50076

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C=C(C(=O)NC2=C1)CN(CCO)S(=O)(=O)C3=CC=CC(=C3)C(=O)OC)C

Isomeric SMILES

CC1=CC(=C2C=C(C(=O)NC2=C1)CN(CCO)S(=O)(=O)C3=CC=CC(=C3)C(=O)OC)C

InChI

InChI=1S/C22H24N2O6S/c1-14-9-15(2)19-12-17(21(26)23-20(19)10-14)13-24(7-8-25)31(28,29)18-6-4-5-16(11-18)22(27)30-3/h4-6,9-12,25H,7-8,13H2,1-3H3,(H,23,26)