2-[3,5-bis(trifluoromethyl)phenyl]ethanesulfonic acid

Systemtic Name: 2-[3,5-bis(trifluoromethyl)phenyl]ethanesulfonic acid Openeye Name: 2-[3,5-bis(trifluoromethyl)phenyl]ethanesulfonic acid CAS Name: 2-[3,5-bis(trifluoromethyl)phenyl]ethanesulfonic acid IUPAC Name: 2-[3,5-bis(trifluoromethyl)phenyl]ethanesulfonic acid Traditional Name: 2-[3,5-bis(trifluoromethyl)phenyl]ethanesulfonic acid Formula: C10H8F6O3S MolecularWeight: 322.224139

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C=C1C(F)(F)F)C(F)(F)F)CCS(=O)(=O)O

Isomeric SMILES

C1=C(C=C(C=C1C(F)(F)F)C(F)(F)F)CCS(=O)(=O)O

InChI

InChI=1S/C10H8F6O3S/c11-9(12,13)7-3-6(1-2-20(17,18)19)4-8(5-7)10(14,15)16/h3-5H,1-2H2,(H,17,18,19)