methyl 4-[(5,7-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl-(3-oxidanylpropyl)sulfamoyl]benzoate

Systemtic Name: methyl 4-[(5,7-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl-(3-oxidanylpropyl)sulfamoyl]benzoate Openeye Name: methyl 4-[(5,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl-(3-hydroxypropyl)sulfamoyl]benzoate CAS Name: 4-[(5,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl-(3-hydroxypropyl)sulfamoyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(5,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl-(3-hydroxypropyl)sulfamoyl]benzoate Traditional Name: 4-[3-hydroxypropyl-[(2-keto-5,7-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=CC(=C2C=C(C(=O)NC2=C1)CN(CCCO)S(=O)(=O)C3=CC=C(C=C3)C(=O)OC)C

Isomeric SMILES

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

InChI

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