[2-[[2,6-bis(chloranyl)-4-sulfamoyl-phenyl]amino]-2-oxidanylidene-ethyl] 3-methyl-2-phenyl-quinoline-4-carboxylate

Systemtic Name: [2-[[2,6-bis(chloranyl)-4-sulfamoyl-phenyl]amino]-2-oxidanylidene-ethyl] 3-methyl-2-phenyl-quinoline-4-carboxylate Openeye Name: [2-(2,6-dichloro-4-sulfamoyl-anilino)-2-oxo-ethyl] 3-methyl-2-phenyl-quinoline-4-carboxylate CAS Name: 3-methyl-2-phenyl-4-quinolinecarboxylic acid [2-(2,6-dichloro-4-sulfamoylanilino)-2-oxoethyl] ester IUPAC Name: [2-(2,6-dichloro-4-sulfamoylanilino)-2-oxoethyl] 3-methyl-2-phenylquinoline-4-carboxylate Traditional Name: 3-methyl-2-phenyl-cinchoninic acid [2-(2,6-dichloro-4-sulfamoyl-anilino)-2-keto-ethyl] ester Formula: C25H19Cl2N3O5S MolecularWeight: 544.40646

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N=C1C3=CC=CC=C3)C(=O)OCC(=O)NC4=C(C=C(C=C4Cl)S(=O)(=O)N)Cl

Isomeric SMILES

CC1=C(C2=CC=CC=C2N=C1C3=CC=CC=C3)C(=O)OCC(=O)NC4=C(C=C(C=C4Cl)S(=O)(=O)N)Cl

InChI

InChI=1S/C25H19Cl2N3O5S/c1-14-22(17-9-5-6-10-20(17)29-23(14)15-7-3-2-4-8-15)25(32)35-13-21(31)30-24-18(26)11-16(12-19(24)27)36(28,33)34/h2-12H,13H2,1H3,(H,30,31)(H2,28,33,34)