methyl 4-[(6-ethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl-(3-oxidanylpropyl)sulfamoyl]benzoate

Systemtic Name: methyl 4-[(6-ethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl-(3-oxidanylpropyl)sulfamoyl]benzoate Openeye Name: methyl 4-[(6-ethyl-2-oxo-1H-quinolin-3-yl)methyl-(3-hydroxypropyl)sulfamoyl]benzoate CAS Name: 4-[(6-ethyl-2-oxo-1H-quinolin-3-yl)methyl-(3-hydroxypropyl)sulfamoyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(6-ethyl-2-oxo-1H-quinolin-3-yl)methyl-(3-hydroxypropyl)sulfamoyl]benzoate Traditional Name: 4-[(6-ethyl-2-keto-1H-quinolin-3-yl)methyl-(3-hydroxypropyl)sulfamoyl]benzoic acid methyl ester Formula: C23H26N2O6S MolecularWeight: 458.52734

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)NC(=O)C(=C2)CN(CCCO)S(=O)(=O)C3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CCC1=CC2=C(C=C1)NC(=O)C(=C2)CN(CCCO)S(=O)(=O)C3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C23H26N2O6S/c1-3-16-5-10-21-18(13-16)14-19(22(27)24-21)15-25(11-4-12-26)32(29,30)20-8-6-17(7-9-20)23(28)31-2/h5-10,13-14,26H,3-4,11-12,15H2,1-2H3,(H,24,27)