[1-oxidanylidene-1-[(4-sulfamoylphenyl)amino]propan-2-yl] 3-ethyl-2-propyl-quinoline-4-carboxylate

Systemtic Name: [1-oxidanylidene-1-[(4-sulfamoylphenyl)amino]propan-2-yl] 3-ethyl-2-propyl-quinoline-4-carboxylate Openeye Name: [1-methyl-2-oxo-2-(4-sulfamoylanilino)ethyl] 3-ethyl-2-propyl-quinoline-4-carboxylate CAS Name: 3-ethyl-2-propyl-4-quinolinecarboxylic acid [1-oxo-1-(4-sulfamoylanilino)propan-2-yl] ester IUPAC Name: [1-oxo-1-(4-sulfamoylanilino)propan-2-yl] 3-ethyl-2-propylquinoline-4-carboxylate Traditional Name: 3-ethyl-2-propyl-cinchoninic acid [2-keto-1-methyl-2-(4-sulfamoylanilino)ethyl] ester Formula: C24H27N3O5S MolecularWeight: 469.55328

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC2=CC=CC=C2C(=C1CC)C(=O)OC(C)C(=O)NC3=CC=C(C=C3)S(=O)(=O)N

Isomeric SMILES

CCCC1=NC2=CC=CC=C2C(=C1CC)C(=O)OC(C)C(=O)NC3=CC=C(C=C3)S(=O)(=O)N

InChI

InChI=1S/C24H27N3O5S/c1-4-8-20-18(5-2)22(19-9-6-7-10-21(19)27-20)24(29)32-15(3)23(28)26-16-11-13-17(14-12-16)33(25,30)31/h6-7,9-15H,4-5,8H2,1-3H3,(H,26,28)(H2,25,30,31)