4-chloranyl-2-[[3-(trifluoromethyl)phenyl]carbamoylamino]benzenesulfonic acid

Systemtic Name: 4-chloranyl-2-[[3-(trifluoromethyl)phenyl]carbamoylamino]benzenesulfonic acid Openeye Name: 4-chloro-2-[[3-(trifluoromethyl)phenyl]carbamoylamino]benzenesulfonic acid CAS Name: 4-chloro-2-[[oxo-[3-(trifluoromethyl)anilino]methyl]amino]benzenesulfonic acid IUPAC Name: 4-chloro-2-[[3-(trifluoromethyl)phenyl]carbamoylamino]benzenesulfonic acid Traditional Name: 4-chloro-2-[[3-(trifluoromethyl)phenyl]carbamoylamino]besylic acid Formula: C14H10ClF3N2O4S MolecularWeight: 394.75341

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)NC2=C(C=CC(=C2)Cl)S(=O)(=O)O)C(F)(F)F

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)NC2=C(C=CC(=C2)Cl)S(=O)(=O)O)C(F)(F)F

InChI

InChI=1S/C14H10ClF3N2O4S/c15-9-4-5-12(25(22,23)24)11(7-9)20-13(21)19-10-3-1-2-8(6-10)14(16,17)18/h1-7H,(H2,19,20,21)(H,22,23,24)