propan-2-yl 2,2-bis(trifluoromethyl)-3-azabicyclo[2.2.1]hept-5-ene-3-carboxylate

Systemtic Name: propan-2-yl 2,2-bis(trifluoromethyl)-3-azabicyclo[2.2.1]hept-5-ene-3-carboxylate Openeye Name: isopropyl 2,2-bis(trifluoromethyl)-3-azabicyclo[2.2.1]hept-5-ene-3-carboxylate CAS Name: 2,2-bis(trifluoromethyl)-3-azabicyclo[2.2.1]hept-5-ene-3-carboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 2,2-bis(trifluoromethyl)-3-azabicyclo[2.2.1]hept-5-ene-3-carboxylate Traditional Name: 2,2-bis(trifluoromethyl)-3-azabicyclo[2.2.1]hept-5-ene-3-carboxylic acid isopropyl ester Formula: C12H13F6NO2 MolecularWeight: 317.227539

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)N1C2CC(C1(C(F)(F)F)C(F)(F)F)C=C2

Isomeric SMILES

CC(C)OC(=O)N1C2CC(C1(C(F)(F)F)C(F)(F)F)C=C2

InChI

InChI=1S/C12H13F6NO2/c1-6(2)21-9(20)19-8-4-3-7(5-8)10(19,11(13,14)15)12(16,17)18/h3-4,6-8H,5H2,1-2H3