tert-butyl 2-azanyl-5-bromanyl-4-(trifluoromethyl)benzoate

Systemtic Name: tert-butyl 2-azanyl-5-bromanyl-4-(trifluoromethyl)benzoate Openeye Name: tert-butyl 2-amino-5-bromo-4-(trifluoromethyl)benzoate CAS Name: 2-amino-5-bromo-4-(trifluoromethyl)benzoic acid tert-butyl ester IUPAC Name: tert-butyl 2-amino-5-bromo-4-(trifluoromethyl)benzoate Traditional Name: 2-amino-5-bromo-4-(trifluoromethyl)benzoic acid tert-butyl ester Formula: C12H13BrF3NO2 MolecularWeight: 340.13633

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1=CC(=C(C=C1N)C(F)(F)F)Br

Isomeric SMILES

CC(C)(C)OC(=O)C1=CC(=C(C=C1N)C(F)(F)F)Br

InChI

InChI=1S/C12H13BrF3NO2/c1-11(2,3)19-10(18)6-4-8(13)7(5-9(6)17)12(14,15)16/h4-5H,17H2,1-3H3