2-[(2S)-3,3,3-tris(fluoranyl)-2-oxidanyl-propyl]sulfanylbenzoic acid

Systemtic Name: 2-[(2S)-3,3,3-tris(fluoranyl)-2-oxidanyl-propyl]sulfanylbenzoic acid Openeye Name: 2-[(2S)-3,3,3-trifluoro-2-hydroxy-propyl]sulfanylbenzoic acid CAS Name: 2-[[(2S)-3,3,3-trifluoro-2-hydroxypropyl]thio]benzoic acid IUPAC Name: 2-[(2S)-3,3,3-trifluoro-2-hydroxypropyl]sulfanylbenzoic acid Traditional Name: 2-[[(2S)-3,3,3-trifluoro-2-hydroxy-propyl]thio]benzoic acid Formula: C10H9F3O3S MolecularWeight: 266.23687

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)O)SCC(C(F)(F)F)O

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)O)SC[C@H](C(F)(F)F)O

InChI

InChI=1S/C10H9F3O3S/c11-10(12,13)8(14)5-17-7-4-2-1-3-6(7)9(15)16/h1-4,8,14H,5H2,(H,15,16)/t8-/m1/s1