4-phenyl-4-[[[2-(trifluoromethyloxy)phenyl]sulfonylamino]methyl]piperidine-1-sulfonic acid

Systemtic Name: 4-phenyl-4-[[[2-(trifluoromethyloxy)phenyl]sulfonylamino]methyl]piperidine-1-sulfonic acid Openeye Name: 4-phenyl-4-[[[2-(trifluoromethoxy)phenyl]sulfonylamino]methyl]piperidine-1-sulfonic acid CAS Name: 4-phenyl-4-[[[2-(trifluoromethoxy)phenyl]sulfonylamino]methyl]-1-piperidinesulfonic acid IUPAC Name: 4-phenyl-4-[[[2-(trifluoromethoxy)phenyl]sulfonylamino]methyl]piperidine-1-sulfonic acid Traditional Name: 4-phenyl-4-[[[2-(trifluoromethoxy)phenyl]sulfonylamino]methyl]piperidine-1-sulfonic acid Formula: C19H21F3N2O6S2 MolecularWeight: 494.50505

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1(CNS(=O)(=O)C2=CC=CC=C2OC(F)(F)F)C3=CC=CC=C3)S(=O)(=O)O

Isomeric SMILES

C1CN(CCC1(CNS(=O)(=O)C2=CC=CC=C2OC(F)(F)F)C3=CC=CC=C3)S(=O)(=O)O

InChI

InChI=1S/C19H21F3N2O6S2/c20-19(21,22)30-16-8-4-5-9-17(16)31(25,26)23-14-18(15-6-2-1-3-7-15)10-12-24(13-11-18)32(27,28)29/h1-9,23H,10-14H2,(H,27,28,29)