methyl 2-tert-butyl-5-(trifluoromethyl)benzoate

Systemtic Name: methyl 2-tert-butyl-5-(trifluoromethyl)benzoate Openeye Name: methyl 2-tert-butyl-5-(trifluoromethyl)benzoate CAS Name: 2-tert-butyl-5-(trifluoromethyl)benzoic acid methyl ester IUPAC Name: methyl 2-tert-butyl-5-(trifluoromethyl)benzoate Traditional Name: 2-tert-butyl-5-(trifluoromethyl)benzoic acid methyl ester Formula: C13H15F3O2 MolecularWeight: 260.25221

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H15F3O2/c1-12(2,3)10-6-5-8(13(14,15)16)7-9(10)11(17)18-4/h5-7H,1-4H3