[4-[methyl(thiophen-2-ylsulfonyl)amino]phenyl] 2-(trifluoromethyl)benzenesulfonate

Systemtic Name: [4-[methyl(thiophen-2-ylsulfonyl)amino]phenyl] 2-(trifluoromethyl)benzenesulfonate Openeye Name: [4-[methyl(2-thienylsulfonyl)amino]phenyl] 2-(trifluoromethyl)benzenesulfonate CAS Name: 2-(trifluoromethyl)benzenesulfonic acid [4-[methyl(thiophen-2-ylsulfonyl)amino]phenyl] ester IUPAC Name: [4-[methyl(thiophen-2-ylsulfonyl)amino]phenyl] 2-(trifluoromethyl)benzenesulfonate Traditional Name: 2-(trifluoromethyl)benzenesulfonic acid [4-[methyl(2-thienylsulfonyl)amino]phenyl] ester Formula: C18H14F3NO5S3 MolecularWeight: 477.49767

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=C(C=C1)OS(=O)(=O)C2=CC=CC=C2C(F)(F)F)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

CN(C1=CC=C(C=C1)OS(=O)(=O)C2=CC=CC=C2C(F)(F)F)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C18H14F3NO5S3/c1-22(29(23,24)17-7-4-12-28-17)13-8-10-14(11-9-13)27-30(25,26)16-6-3-2-5-15(16)18(19,20)21/h2-12H,1H3