[3-(dimethylcarbamoyl)phenyl] 4-chloranyl-3-(trifluoromethyl)benzenesulfonate

Systemtic Name: [3-(dimethylcarbamoyl)phenyl] 4-chloranyl-3-(trifluoromethyl)benzenesulfonate Openeye Name: [3-(dimethylcarbamoyl)phenyl] 4-chloro-3-(trifluoromethyl)benzenesulfonate CAS Name: 4-chloro-3-(trifluoromethyl)benzenesulfonic acid [3-[dimethylamino(oxo)methyl]phenyl] ester IUPAC Name: [3-(dimethylcarbamoyl)phenyl] 4-chloro-3-(trifluoromethyl)benzenesulfonate Traditional Name: 4-chloro-3-(trifluoromethyl)benzenesulfonic acid [3-(dimethylcarbamoyl)phenyl] ester Formula: C16H13ClF3NO4S MolecularWeight: 407.79193

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)C1=CC(=CC=C1)OS(=O)(=O)C2=CC(=C(C=C2)Cl)C(F)(F)F

Isomeric SMILES

CN(C)C(=O)C1=CC(=CC=C1)OS(=O)(=O)C2=CC(=C(C=C2)Cl)C(F)(F)F

InChI

InChI=1S/C16H13ClF3NO4S/c1-21(2)15(22)10-4-3-5-11(8-10)25-26(23,24)12-6-7-14(17)13(9-12)16(18,19)20/h3-9H,1-2H3