2-[(3S)-3-oxidanylpiperidin-1-ium-1-yl]-1-[(2R)-2-thiophen-2-ylpyrrolidin-1-yl]ethanone

Systemtic Name: 2-[(3S)-3-oxidanylpiperidin-1-ium-1-yl]-1-[(2R)-2-thiophen-2-ylpyrrolidin-1-yl]ethanone Openeye Name: 2-[(3S)-3-hydroxypiperidin-1-ium-1-yl]-1-[(2R)-2-(2-thienyl)pyrrolidin-1-yl]ethanone CAS Name: 2-[(3S)-3-hydroxy-1-piperidin-1-iumyl]-1-[(2R)-2-thiophen-2-yl-1-pyrrolidinyl]ethanone IUPAC Name: 2-[(3S)-3-hydroxypiperidin-1-ium-1-yl]-1-[(2R)-2-thiophen-2-ylpyrrolidin-1-yl]ethanone Traditional Name: 2-[(3S)-3-hydroxypiperidin-1-ium-1-yl]-1-[(2R)-2-(2-thienyl)pyrrolidino]ethanone Formula: C15H23N2O2S+ MolecularWeight: 295.42032

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH+](C1)CC(=O)N2CCCC2C3=CC=CS3)O

Isomeric SMILES

C1C[C@@H](C[NH+](C1)CC(=O)N2CCC[C@@H]2C3=CC=CS3)O

InChI

InChI=1S/C15H22N2O2S/c18-12-4-1-7-16(10-12)11-15(19)17-8-2-5-13(17)14-6-3-9-20-14/h3,6,9,12-13,18H,1-2,4-5,7-8,10-11H2/p+1/t12-,13+/m0/s1