6-(diethylsulfamoyl)-2-(3-methoxyphenyl)quinoline-4-carboxylic acid

Systemtic Name: 6-(diethylsulfamoyl)-2-(3-methoxyphenyl)quinoline-4-carboxylic acid Openeye Name: 6-(diethylsulfamoyl)-2-(3-methoxyphenyl)quinoline-4-carboxylic acid CAS Name: 6-(diethylsulfamoyl)-2-(3-methoxyphenyl)-4-quinolinecarboxylic acid IUPAC Name: 6-(diethylsulfamoyl)-2-(3-methoxyphenyl)quinoline-4-carboxylic acid Traditional Name: 6-(diethylsulfamoyl)-2-(3-methoxyphenyl)cinchoninic acid Formula: C21H22N2O5S MolecularWeight: 414.47478

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC2=C(C=C1)N=C(C=C2C(=O)O)C3=CC(=CC=C3)OC

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC2=C(C=C1)N=C(C=C2C(=O)O)C3=CC(=CC=C3)OC

InChI

InChI=1S/C21H22N2O5S/c1-4-23(5-2)29(26,27)16-9-10-19-17(12-16)18(21(24)25)13-20(22-19)14-7-6-8-15(11-14)28-3/h6-13H,4-5H2,1-3H3,(H,24,25)