tert-butyl 6-(6-chloranylpyridin-3-yl)-6-oxidanyl-3-azabicyclo[3.2.0]heptane-3-carboxylate

Systemtic Name: tert-butyl 6-(6-chloranylpyridin-3-yl)-6-oxidanyl-3-azabicyclo[3.2.0]heptane-3-carboxylate Openeye Name: tert-butyl 6-(6-chloro-3-pyridyl)-6-hydroxy-3-azabicyclo[3.2.0]heptane-3-carboxylate CAS Name: 6-(6-chloro-3-pyridinyl)-6-hydroxy-3-azabicyclo[3.2.0]heptane-3-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 6-(6-chloropyridin-3-yl)-6-hydroxy-3-azabicyclo[3.2.0]heptane-3-carboxylate Traditional Name: 6-(6-chloro-3-pyridyl)-6-hydroxy-3-azabicyclo[3.2.0]heptane-3-carboxylic acid tert-butyl ester Formula: C16H21ClN2O3 MolecularWeight: 324.80254

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CC2CC(C2C1)(C3=CN=C(C=C3)Cl)O

Isomeric SMILES

CC(C)(C)OC(=O)N1CC2CC(C2C1)(C3=CN=C(C=C3)Cl)O

InChI

InChI=1S/C16H21ClN2O3/c1-15(2,3)22-14(20)19-8-10-6-16(21,12(10)9-19)11-4-5-13(17)18-7-11/h4-5,7,10,12,21H,6,8-9H2,1-3H3