methyl 3-[(6,7-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl-(3-oxidanylpropyl)sulfamoyl]benzoate

Systemtic Name: methyl 3-[(6,7-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl-(3-oxidanylpropyl)sulfamoyl]benzoate Openeye Name: methyl 3-[(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl-(3-hydroxypropyl)sulfamoyl]benzoate CAS Name: 3-[(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl-(3-hydroxypropyl)sulfamoyl]benzoic acid methyl ester IUPAC Name: methyl 3-[(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl-(3-hydroxypropyl)sulfamoyl]benzoate Traditional Name: 3-[3-hydroxypropyl-[(2-keto-6,7-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=C(C=C2C(=C1)C=C(C(=O)N2)CN(CCCO)S(=O)(=O)C3=CC=CC(=C3)C(=O)OC)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C=C(C(=O)N2)CN(CCCO)S(=O)(=O)C3=CC=CC(=C3)C(=O)OC)C

InChI

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