(3S)-1-(2,2-dimethylpropyl)-3-oxidanyl-3-(pyrrolidin-1-ium-1-ylmethyl)piperidin-2-one

Systemtic Name: (3S)-1-(2,2-dimethylpropyl)-3-oxidanyl-3-(pyrrolidin-1-ium-1-ylmethyl)piperidin-2-one Openeye Name: (3S)-1-(2,2-dimethylpropyl)-3-hydroxy-3-(pyrrolidin-1-ium-1-ylmethyl)piperidin-2-one CAS Name: (3S)-1-(2,2-dimethylpropyl)-3-hydroxy-3-(1-pyrrolidin-1-iumylmethyl)-2-piperidinone IUPAC Name: (3S)-1-(2,2-dimethylpropyl)-3-hydroxy-3-(pyrrolidin-1-ium-1-ylmethyl)piperidin-2-one Traditional Name: (3S)-3-hydroxy-1-neopentyl-3-(pyrrolidin-1-ium-1-ylmethyl)-2-piperidone Formula: C15H29N2O2+ MolecularWeight: 269.40296

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CN1CCCC(C1=O)(C[NH+]2CCCC2)O

Isomeric SMILES

CC(C)(C)CN1CCC[C@@](C1=O)(C[NH+]2CCCC2)O

InChI

InChI=1S/C15H28N2O2/c1-14(2,3)11-17-10-6-7-15(19,13(17)18)12-16-8-4-5-9-16/h19H,4-12H2,1-3H3/p+1/t15-/m0/s1