1-[(3S,4R)-1-tert-butyl-3-methyl-4-oxidanyl-piperidin-1-ium-4-yl]ethanone

Systemtic Name: 1-[(3S,4R)-1-tert-butyl-3-methyl-4-oxidanyl-piperidin-1-ium-4-yl]ethanone Openeye Name: 1-[(3S,4R)-1-tert-butyl-4-hydroxy-3-methyl-piperidin-1-ium-4-yl]ethanone CAS Name: 1-[(3S,4R)-1-tert-butyl-4-hydroxy-3-methyl-4-piperidin-1-iumyl]ethanone IUPAC Name: 1-[(3S,4R)-1-tert-butyl-4-hydroxy-3-methylpiperidin-1-ium-4-yl]ethanone Traditional Name: 1-[(3S,4R)-1-tert-butyl-4-hydroxy-3-methyl-piperidin-1-ium-4-yl]ethanone Formula: C12H24NO2+ MolecularWeight: 214.32446

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Descriptors Computed from Structure

Canonical SMILES:

CC1C[NH+](CCC1(C(=O)C)O)C(C)(C)C

Isomeric SMILES

C[C@H]1C[NH+](CC[C@@]1(C(=O)C)O)C(C)(C)C

InChI

InChI=1S/C12H23NO2/c1-9-8-13(11(3,4)5)7-6-12(9,15)10(2)14/h9,15H,6-8H2,1-5H3/p+1/t9-,12+/m0/s1