3-[4-(trifluoromethyl)phenyl]propanoate

Systemtic Name: 3-[4-(trifluoromethyl)phenyl]propanoate Openeye Name: 3-[4-(trifluoromethyl)phenyl]propanoate CAS Name: 3-[4-(trifluoromethyl)phenyl]propanoate IUPAC Name: 3-[4-(trifluoromethyl)phenyl]propanoate Traditional Name: 3-[4-(trifluoromethyl)phenyl]propionate Formula: C10H8F3O2- MolecularWeight: 217.16453

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCC(=O)[O-])C(F)(F)F

Isomeric SMILES

C1=CC(=CC=C1CCC(=O)[O-])C(F)(F)F

InChI

InChI=1S/C10H9F3O2/c11-10(12,13)8-4-1-7(2-5-8)3-6-9(14)15/h1-2,4-5H,3,6H2,(H,14,15)/p-1