tert-butyl 2-methyl-3-(trifluoromethyl)-7-azabicyclo[2.2.1]hepta-2,5-diene-7-carboxylate

Systemtic Name: tert-butyl 2-methyl-3-(trifluoromethyl)-7-azabicyclo[2.2.1]hepta-2,5-diene-7-carboxylate Openeye Name: tert-butyl 2-methyl-3-(trifluoromethyl)-7-azabicyclo[2.2.1]hepta-2,5-diene-7-carboxylate CAS Name: 2-methyl-3-(trifluoromethyl)-7-azabicyclo[2.2.1]hepta-2,5-diene-7-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-methyl-3-(trifluoromethyl)-7-azabicyclo[2.2.1]hepta-2,5-diene-7-carboxylate Traditional Name: 2-methyl-3-(trifluoromethyl)-7-azabicyclo[2.2.1]hepta-2,5-diene-7-carboxylic acid tert-butyl ester Formula: C13H16F3NO2 MolecularWeight: 275.26685

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2C=CC1N2C(=O)OC(C)(C)C)C(F)(F)F

Isomeric SMILES

CC1=C(C2C=CC1N2C(=O)OC(C)(C)C)C(F)(F)F

InChI

InChI=1S/C13H16F3NO2/c1-7-8-5-6-9(10(7)13(14,15)16)17(8)11(18)19-12(2,3)4/h5-6,8-9H,1-4H3