tert-butyl (1R,5R)-4-propanoyl-8-azabicyclo[3.2.1]octa-3,6-diene-8-carboxylate

Systemtic Name: tert-butyl (1R,5R)-4-propanoyl-8-azabicyclo[3.2.1]octa-3,6-diene-8-carboxylate Openeye Name: tert-butyl (1R,5R)-4-propanoyl-8-azabicyclo[3.2.1]octa-3,6-diene-8-carboxylate CAS Name: (1R,5R)-4-(1-oxopropyl)-8-azabicyclo[3.2.1]octa-3,6-diene-8-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl (1R,5R)-4-propanoyl-8-azabicyclo[3.2.1]octa-3,6-diene-8-carboxylate Traditional Name: (1R,5R)-4-propionyl-8-azabicyclo[3.2.1]octa-3,6-diene-8-carboxylic acid tert-butyl ester Formula: C15H21NO3 MolecularWeight: 263.33214

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=CCC2C=CC1N2C(=O)OC(C)(C)C

Isomeric SMILES

CCC(=O)C1=CC[C@@H]2C=C[C@H]1N2C(=O)OC(C)(C)C

InChI

InChI=1S/C15H21NO3/c1-5-13(17)11-8-6-10-7-9-12(11)16(10)14(18)19-15(2,3)4/h7-10,12H,5-6H2,1-4H3/t10-,12-/m1/s1