5-[2-chloranyl-4-(trifluoromethyl)phenoxy]-2-sulfo-benzoic acid

Systemtic Name: 5-[2-chloranyl-4-(trifluoromethyl)phenoxy]-2-sulfo-benzoic acid Openeye Name: 5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-sulfo-benzoic acid CAS Name: 5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-sulfobenzoic acid IUPAC Name: 5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-sulfobenzoic acid Traditional Name: 5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-sulfo-benzoic acid Formula: C14H8ClF3O6S MolecularWeight: 396.72293

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(F)(F)F)Cl)OC2=CC(=C(C=C2)S(=O)(=O)O)C(=O)O

Isomeric SMILES

C1=CC(=C(C=C1C(F)(F)F)Cl)OC2=CC(=C(C=C2)S(=O)(=O)O)C(=O)O

InChI

InChI=1S/C14H8ClF3O6S/c15-10-5-7(14(16,17)18)1-3-11(10)24-8-2-4-12(25(21,22)23)9(6-8)13(19)20/h1-6H,(H,19,20)(H,21,22,23)