tert-butyl 5-(5-methoxypyrazin-2-yl)-5-oxidanyl-3-azabicyclo[2.2.2]octane-3-carboxylate

Systemtic Name: tert-butyl 5-(5-methoxypyrazin-2-yl)-5-oxidanyl-3-azabicyclo[2.2.2]octane-3-carboxylate Openeye Name: tert-butyl 5-hydroxy-5-(5-methoxypyrazin-2-yl)-3-azabicyclo[2.2.2]octane-3-carboxylate CAS Name: 5-hydroxy-5-(5-methoxy-2-pyrazinyl)-3-azabicyclo[2.2.2]octane-3-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 5-hydroxy-5-(5-methoxypyrazin-2-yl)-3-azabicyclo[2.2.2]octane-3-carboxylate Traditional Name: 5-hydroxy-5-(5-methoxypyrazin-2-yl)-3-azabicyclo[2.2.2]octane-3-carboxylic acid tert-butyl ester Formula: C17H25N3O4 MolecularWeight: 335.3981

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CC2CCC1C(C2)(C3=CN=C(C=N3)OC)O

Isomeric SMILES

CC(C)(C)OC(=O)N1CC2CCC1C(C2)(C3=CN=C(C=N3)OC)O

InChI

InChI=1S/C17H25N3O4/c1-16(2,3)24-15(21)20-10-11-5-6-13(20)17(22,7-11)12-8-19-14(23-4)9-18-12/h8-9,11,13,22H,5-7,10H2,1-4H3