3-[2,5-bis(trifluoromethyl)phenyl]propanoate

Systemtic Name: 3-[2,5-bis(trifluoromethyl)phenyl]propanoate Openeye Name: 3-[2,5-bis(trifluoromethyl)phenyl]propanoate CAS Name: 3-[2,5-bis(trifluoromethyl)phenyl]propanoate IUPAC Name: 3-[2,5-bis(trifluoromethyl)phenyl]propanoate Traditional Name: 3-[2,5-bis(trifluoromethyl)phenyl]propionate Formula: C11H7F6O2- MolecularWeight: 285.162499

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(F)(F)F)CCC(=O)[O-])C(F)(F)F

Isomeric SMILES

C1=CC(=C(C=C1C(F)(F)F)CCC(=O)[O-])C(F)(F)F

InChI

InChI=1S/C11H8F6O2/c12-10(13,14)7-2-3-8(11(15,16)17)6(5-7)1-4-9(18)19/h2-3,5H,1,4H2,(H,18,19)/p-1