tert-butyl (1S,4S,7R)-7-tert-butylsulfanyl-5-azabicyclo[2.2.1]hept-2-ene-5-carboxylate

Systemtic Name: tert-butyl (1S,4S,7R)-7-tert-butylsulfanyl-5-azabicyclo[2.2.1]hept-2-ene-5-carboxylate Openeye Name: tert-butyl (1S,4S,7R)-7-tert-butylsulfanyl-5-azabicyclo[2.2.1]hept-2-ene-5-carboxylate CAS Name: (1S,4S,7R)-7-(tert-butylthio)-5-azabicyclo[2.2.1]hept-2-ene-5-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl (1S,4S,7R)-7-tert-butylsulfanyl-5-azabicyclo[2.2.1]hept-2-ene-5-carboxylate Traditional Name: (1S,4S,7R)-7-(tert-butylthio)-5-azabicyclo[2.2.1]hept-2-ene-5-carboxylic acid tert-butyl ester Formula: C15H25NO2S MolecularWeight: 283.4295

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CC2C=CC1C2SC(C)(C)C

Isomeric SMILES

CC(C)(C)OC(=O)N1C[C@@H]2C=C[C@H]1[C@@H]2SC(C)(C)C

InChI

InChI=1S/C15H25NO2S/c1-14(2,3)18-13(17)16-9-10-7-8-11(16)12(10)19-15(4,5)6/h7-8,10-12H,9H2,1-6H3/t10-,11-,12+/m0/s1