[1-oxidanylidene-1-[(3-sulfamoylphenyl)amino]propan-2-yl] 2-propan-2-ylquinoline-4-carboxylate

Systemtic Name: [1-oxidanylidene-1-[(3-sulfamoylphenyl)amino]propan-2-yl] 2-propan-2-ylquinoline-4-carboxylate Openeye Name: [1-methyl-2-oxo-2-(3-sulfamoylanilino)ethyl] 2-isopropylquinoline-4-carboxylate CAS Name: 2-propan-2-yl-4-quinolinecarboxylic acid [1-oxo-1-(3-sulfamoylanilino)propan-2-yl] ester IUPAC Name: [1-oxo-1-(3-sulfamoylanilino)propan-2-yl] 2-propan-2-ylquinoline-4-carboxylate Traditional Name: 2-isopropylcinchoninic acid [2-keto-1-methyl-2-(3-sulfamoylanilino)ethyl] ester Formula: C22H23N3O5S MolecularWeight: 441.50012

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC2=CC=CC=C2C(=C1)C(=O)OC(C)C(=O)NC3=CC(=CC=C3)S(=O)(=O)N

Isomeric SMILES

CC(C)C1=NC2=CC=CC=C2C(=C1)C(=O)OC(C)C(=O)NC3=CC(=CC=C3)S(=O)(=O)N

InChI

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