2-[3-chloranyl-4-(trifluoromethylsulfonyl)phenyl]ethanoic acid

Systemtic Name: 2-[3-chloranyl-4-(trifluoromethylsulfonyl)phenyl]ethanoic acid Openeye Name: 2-[3-chloro-4-(trifluoromethylsulfonyl)phenyl]acetic acid CAS Name: 2-[3-chloro-4-(trifluoromethylsulfonyl)phenyl]acetic acid IUPAC Name: 2-[3-chloro-4-(trifluoromethylsulfonyl)phenyl]acetic acid Traditional Name: 2-(3-chloro-4-triflyl-phenyl)acetic acid Formula: C9H6ClF3O4S MolecularWeight: 302.65475

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1CC(=O)O)Cl)S(=O)(=O)C(F)(F)F

Isomeric SMILES

C1=CC(=C(C=C1CC(=O)O)Cl)S(=O)(=O)C(F)(F)F

InChI

InChI=1S/C9H6ClF3O4S/c10-6-3-5(4-8(14)15)1-2-7(6)18(16,17)9(11,12)13/h1-3H,4H2,(H,14,15)