(3R)-1-(2,2-dimethylpropyl)-3-[[(3-methyl-1H-imidazol-3-ium-2-yl)methylamino]methyl]-3-oxidanyl-piperidin-2-one

Systemtic Name: (3R)-1-(2,2-dimethylpropyl)-3-[[(3-methyl-1H-imidazol-3-ium-2-yl)methylamino]methyl]-3-oxidanyl-piperidin-2-one Openeye Name: (3R)-1-(2,2-dimethylpropyl)-3-hydroxy-3-[[(3-methyl-1H-imidazol-3-ium-2-yl)methylamino]methyl]piperidin-2-one CAS Name: (3R)-1-(2,2-dimethylpropyl)-3-hydroxy-3-[[(3-methyl-1H-imidazol-3-ium-2-yl)methylamino]methyl]-2-piperidinone IUPAC Name: (3R)-1-(2,2-dimethylpropyl)-3-hydroxy-3-[[(3-methyl-1H-imidazol-3-ium-2-yl)methylamino]methyl]piperidin-2-one Traditional Name: (3R)-3-hydroxy-3-[[(3-methyl-1H-imidazol-3-ium-2-yl)methylamino]methyl]-1-neopentyl-2-piperidone Formula: C16H29N4O2+ MolecularWeight: 309.42706

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CN1CCCC(C1=O)(CNCC2=[N+](C=CN2)C)O

Isomeric SMILES

CC(C)(C)CN1CCC[C@](C1=O)(CNCC2=[N+](C=CN2)C)O

InChI

InChI=1S/C16H28N4O2/c1-15(2,3)12-20-8-5-6-16(22,14(20)21)11-17-10-13-18-7-9-19(13)4/h7,9,17,22H,5-6,8,10-12H2,1-4H3/p+1/t16-/m1/s1