methyl 2-[(6-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl-(3-oxidanylpropyl)sulfamoyl]benzoate

Systemtic Name: methyl 2-[(6-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl-(3-oxidanylpropyl)sulfamoyl]benzoate Openeye Name: methyl 2-[3-hydroxypropyl-[(6-methyl-2-oxo-1H-quinolin-3-yl)methyl]sulfamoyl]benzoate CAS Name: 2-[3-hydroxypropyl-[(6-methyl-2-oxo-1H-quinolin-3-yl)methyl]sulfamoyl]benzoic acid methyl ester IUPAC Name: methyl 2-[3-hydroxypropyl-[(6-methyl-2-oxo-1H-quinolin-3-yl)methyl]sulfamoyl]benzoate Traditional Name: 2-[3-hydroxypropyl-[(2-keto-6-methyl-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=CC2=C(C=C1)NC(=O)C(=C2)CN(CCCO)S(=O)(=O)C3=CC=CC=C3C(=O)OC

Isomeric SMILES

CC1=CC2=C(C=C1)NC(=O)C(=C2)CN(CCCO)S(=O)(=O)C3=CC=CC=C3C(=O)OC

InChI

InChI=1S/C22H24N2O6S/c1-15-8-9-19-16(12-15)13-17(21(26)23-19)14-24(10-5-11-25)31(28,29)20-7-4-3-6-18(20)22(27)30-2/h3-4,6-9,12-13,25H,5,10-11,14H2,1-2H3,(H,23,26)