3-[[5-chloranyl-2-[(4-chloranyl-2-methyl-phenyl)carbamoyl]phenyl]sulfamoyl]benzoic acid

Systemtic Name: 3-[[5-chloranyl-2-[(4-chloranyl-2-methyl-phenyl)carbamoyl]phenyl]sulfamoyl]benzoic acid Openeye Name: 3-[[5-chloro-2-[(4-chloro-2-methyl-phenyl)carbamoyl]phenyl]sulfamoyl]benzoic acid CAS Name: 3-[[5-chloro-2-[(4-chloro-2-methylanilino)-oxomethyl]phenyl]sulfamoyl]benzoic acid IUPAC Name: 3-[[5-chloro-2-[(4-chloro-2-methylphenyl)carbamoyl]phenyl]sulfamoyl]benzoic acid Traditional Name: 3-[[5-chloro-2-[(4-chloro-2-methyl-phenyl)carbamoyl]phenyl]sulfamoyl]benzoic acid Formula: C21H16Cl2N2O5S MolecularWeight: 479.33314

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)NC(=O)C2=C(C=C(C=C2)Cl)NS(=O)(=O)C3=CC=CC(=C3)C(=O)O

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)NC(=O)C2=C(C=C(C=C2)Cl)NS(=O)(=O)C3=CC=CC(=C3)C(=O)O

InChI

InChI=1S/C21H16Cl2N2O5S/c1-12-9-14(22)6-8-18(12)24-20(26)17-7-5-15(23)11-19(17)25-31(29,30)16-4-2-3-13(10-16)21(27)28/h2-11,25H,1H3,(H,24,26)(H,27,28)