[3-(trifluoromethyl)phenyl] 4-(phenylsulfonyl)thiophene-2-sulfonate

Systemtic Name: [3-(trifluoromethyl)phenyl] 4-(phenylsulfonyl)thiophene-2-sulfonate Openeye Name: [3-(trifluoromethyl)phenyl] 4-(benzenesulfonyl)thiophene-2-sulfonate CAS Name: 4-(benzenesulfonyl)-2-thiophenesulfonic acid [3-(trifluoromethyl)phenyl] ester IUPAC Name: [3-(trifluoromethyl)phenyl] 4-(benzenesulfonyl)thiophene-2-sulfonate Traditional Name: 4-besylthiophene-2-sulfonic acid [3-(trifluoromethyl)phenyl] ester Formula: C17H11F3O5S3 MolecularWeight: 448.45645

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)C2=CSC(=C2)S(=O)(=O)OC3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)C2=CSC(=C2)S(=O)(=O)OC3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C17H11F3O5S3/c18-17(19,20)12-5-4-6-13(9-12)25-28(23,24)16-10-15(11-26-16)27(21,22)14-7-2-1-3-8-14/h1-11H