4-[2,4-bis(trifluoromethyl)phenyl]butan-2-yl ethanoate

Systemtic Name: 4-[2,4-bis(trifluoromethyl)phenyl]butan-2-yl ethanoate Openeye Name: [3-[2,4-bis(trifluoromethyl)phenyl]-1-methyl-propyl] acetate CAS Name: acetic acid 4-[2,4-bis(trifluoromethyl)phenyl]butan-2-yl ester IUPAC Name: 4-[2,4-bis(trifluoromethyl)phenyl]butan-2-yl acetate Traditional Name: acetic acid [3-[2,4-bis(trifluoromethyl)phenyl]-1-methyl-propyl] ester Formula: C14H14F6O2 MolecularWeight: 328.250179

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=C(C=C(C=C1)C(F)(F)F)C(F)(F)F)OC(=O)C

Isomeric SMILES

CC(CCC1=C(C=C(C=C1)C(F)(F)F)C(F)(F)F)OC(=O)C

InChI

InChI=1S/C14H14F6O2/c1-8(22-9(2)21)3-4-10-5-6-11(13(15,16)17)7-12(10)14(18,19)20/h5-8H,3-4H2,1-2H3