4-chloranyl-3-[(phenylmethyl)-[3-(trifluoromethyl)phenyl]sulfamoyl]benzoate

Systemtic Name: 4-chloranyl-3-[(phenylmethyl)-[3-(trifluoromethyl)phenyl]sulfamoyl]benzoate Openeye Name: 3-[benzyl-[3-(trifluoromethyl)phenyl]sulfamoyl]-4-chloro-benzoate CAS Name: 4-chloro-3-[(phenylmethyl)-[3-(trifluoromethyl)phenyl]sulfamoyl]benzoate IUPAC Name: 3-[benzyl-[3-(trifluoromethyl)phenyl]sulfamoyl]-4-chlorobenzoate Traditional Name: 3-[benzyl-[3-(trifluoromethyl)phenyl]sulfamoyl]-4-chloro-benzoate Formula: C21H14ClF3NO4S- MolecularWeight: 468.85337

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(C2=CC=CC(=C2)C(F)(F)F)S(=O)(=O)C3=C(C=CC(=C3)C(=O)[O-])Cl

Isomeric SMILES

C1=CC=C(C=C1)CN(C2=CC=CC(=C2)C(F)(F)F)S(=O)(=O)C3=C(C=CC(=C3)C(=O)[O-])Cl

InChI

InChI=1S/C21H15ClF3NO4S/c22-18-10-9-15(20(27)28)11-19(18)31(29,30)26(13-14-5-2-1-3-6-14)17-8-4-7-16(12-17)21(23,24)25/h1-12H,13H2,(H,27,28)/p-1