methyl 2-[(5,8-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl-(3-oxidanylpropyl)sulfamoyl]benzoate

Systemtic Name: methyl 2-[(5,8-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl-(3-oxidanylpropyl)sulfamoyl]benzoate Openeye Name: methyl 2-[(5,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl-(3-hydroxypropyl)sulfamoyl]benzoate CAS Name: 2-[(5,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl-(3-hydroxypropyl)sulfamoyl]benzoic acid methyl ester IUPAC Name: methyl 2-[(5,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl-(3-hydroxypropyl)sulfamoyl]benzoate Traditional Name: 2-[3-hydroxypropyl-[(2-keto-5,8-dimethyl-1H-quinolin-3-yl)methyl]sulfamoyl]benzoic acid methyl ester Formula: C23H26N2O6S MolecularWeight: 458.52734

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=C(C(=O)NC2=C(C=C1)C)CN(CCCO)S(=O)(=O)C3=CC=CC=C3C(=O)OC

Isomeric SMILES

CC1=C2C=C(C(=O)NC2=C(C=C1)C)CN(CCCO)S(=O)(=O)C3=CC=CC=C3C(=O)OC

InChI

InChI=1S/C23H26N2O6S/c1-15-9-10-16(2)21-19(15)13-17(22(27)24-21)14-25(11-6-12-26)32(29,30)20-8-5-4-7-18(20)23(28)31-3/h4-5,7-10,13,26H,6,11-12,14H2,1-3H3,(H,24,27)