[2-oxidanylidene-2-[1-(4-sulfamoylphenyl)ethylamino]ethyl] 2,6-dimethylquinoline-3-carboxylate

Systemtic Name: [2-oxidanylidene-2-[1-(4-sulfamoylphenyl)ethylamino]ethyl] 2,6-dimethylquinoline-3-carboxylate Openeye Name: [2-oxo-2-[1-(4-sulfamoylphenyl)ethylamino]ethyl] 2,6-dimethylquinoline-3-carboxylate CAS Name: 2,6-dimethyl-3-quinolinecarboxylic acid [2-oxo-2-[1-(4-sulfamoylphenyl)ethylamino]ethyl] ester IUPAC Name: [2-oxo-2-[1-(4-sulfamoylphenyl)ethylamino]ethyl] 2,6-dimethylquinoline-3-carboxylate Traditional Name: 2,6-dimethylquinoline-3-carboxylic acid [2-keto-2-[1-(4-sulfamoylphenyl)ethylamino]ethyl] ester Formula: C22H23N3O5S MolecularWeight: 441.50012

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=CC(=C(N=C2C=C1)C)C(=O)OCC(=O)NC(C)C3=CC=C(C=C3)S(=O)(=O)N

Isomeric SMILES

CC1=CC2=CC(=C(N=C2C=C1)C)C(=O)OCC(=O)NC(C)C3=CC=C(C=C3)S(=O)(=O)N

InChI

InChI=1S/C22H23N3O5S/c1-13-4-9-20-17(10-13)11-19(15(3)24-20)22(27)30-12-21(26)25-14(2)16-5-7-18(8-6-16)31(23,28)29/h4-11,14H,12H2,1-3H3,(H,25,26)(H2,23,28,29)