tert-butyl 3-ethynyl-7-azabicyclo[2.2.1]heptane-7-carboxylate

Systemtic Name: tert-butyl 3-ethynyl-7-azabicyclo[2.2.1]heptane-7-carboxylate Openeye Name: tert-butyl 3-ethynyl-7-azabicyclo[2.2.1]heptane-7-carboxylate CAS Name: 3-ethynyl-7-azabicyclo[2.2.1]heptane-7-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-ethynyl-7-azabicyclo[2.2.1]heptane-7-carboxylate Traditional Name: 3-ethynyl-7-azabicyclo[2.2.1]heptane-7-carboxylic acid tert-butyl ester Formula: C13H19NO2 MolecularWeight: 221.29546

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C2CCC1C(C2)C#C

Isomeric SMILES

CC(C)(C)OC(=O)N1C2CCC1C(C2)C#C

InChI

InChI=1S/C13H19NO2/c1-5-9-8-10-6-7-11(9)14(10)12(15)16-13(2,3)4/h1,9-11H,6-8H2,2-4H3