2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanyl-1-piperidin-1-yl-ethanone

Systemtic Name: 2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanyl-1-piperidin-1-yl-ethanone Openeye Name: 2-(1-oxidopyridin-1-ium-2-yl)sulfanyl-1-(1-piperidyl)ethanone CAS Name: 2-[(1-oxido-2-pyridin-1-iumyl)thio]-1-(1-piperidinyl)ethanone IUPAC Name: 2-(1-oxidopyridin-1-ium-2-yl)sulfanyl-1-piperidin-1-ylethanone Traditional Name: 2-[(1-oxidopyridin-1-ium-2-yl)thio]-1-piperidino-ethanone Formula: C12H16N2O2S MolecularWeight: 252.33264

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)CSC2=CC=CC=[N+]2[O-]

Isomeric SMILES

C1CCN(CC1)C(=O)CSC2=CC=CC=[N+]2[O-]

InChI

InChI=1S/C12H16N2O2S/c15-11(13-7-3-1-4-8-13)10-17-12-6-2-5-9-14(12)16/h2,5-6,9H,1,3-4,7-8,10H2