2-[2-(3-ethoxycarbonylphenyl)-3-(trifluoromethylsulfonyloxy)phenyl]ethanoic acid

Systemtic Name: 2-[2-(3-ethoxycarbonylphenyl)-3-(trifluoromethylsulfonyloxy)phenyl]ethanoic acid Openeye Name: 2-[2-(3-ethoxycarbonylphenyl)-3-(trifluoromethylsulfonyloxy)phenyl]acetic acid CAS Name: 2-[2-(3-ethoxycarbonylphenyl)-3-(trifluoromethylsulfonyloxy)phenyl]acetic acid IUPAC Name: 2-[2-(3-ethoxycarbonylphenyl)-3-(trifluoromethylsulfonyloxy)phenyl]acetic acid Traditional Name: 2-[2-(3-carbethoxyphenyl)-3-triflyloxy-phenyl]acetic acid Formula: C18H15F3O7S MolecularWeight: 432.36771

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=CC(=C1)C2=C(C=CC=C2OS(=O)(=O)C(F)(F)F)CC(=O)O

Isomeric SMILES

CCOC(=O)C1=CC=CC(=C1)C2=C(C=CC=C2OS(=O)(=O)C(F)(F)F)CC(=O)O

InChI

InChI=1S/C18H15F3O7S/c1-2-27-17(24)13-7-3-5-11(9-13)16-12(10-15(22)23)6-4-8-14(16)28-29(25,26)18(19,20)21/h3-9H,2,10H2,1H3,(H,22,23)