5-[(1S)-1-[(3S)-3-ethylpiperidin-1-ium-1-yl]ethyl]-3-pyridin-4-yl-1,2,4-oxadiazole

Systemtic Name: 5-[(1S)-1-[(3S)-3-ethylpiperidin-1-ium-1-yl]ethyl]-3-pyridin-4-yl-1,2,4-oxadiazole Openeye Name: 5-[(1S)-1-[(3S)-3-ethylpiperidin-1-ium-1-yl]ethyl]-3-(4-pyridyl)-1,2,4-oxadiazole CAS Name: 5-[(1S)-1-[(3S)-3-ethyl-1-piperidin-1-iumyl]ethyl]-3-pyridin-4-yl-1,2,4-oxadiazole IUPAC Name: 5-[(1S)-1-[(3S)-3-ethylpiperidin-1-ium-1-yl]ethyl]-3-pyridin-4-yl-1,2,4-oxadiazole Traditional Name: 5-[(1S)-1-[(3S)-3-ethylpiperidin-1-ium-1-yl]ethyl]-3-(4-pyridyl)-1,2,4-oxadiazole Formula: C16H23N4O+ MolecularWeight: 287.38002

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCC[NH+](C1)C(C)C2=NC(=NO2)C3=CC=NC=C3

Isomeric SMILES

CC[C@H]1CCC[NH+](C1)[C@@H](C)C2=NC(=NO2)C3=CC=NC=C3

InChI

InChI=1S/C16H22N4O/c1-3-13-5-4-10-20(11-13)12(2)16-18-15(19-21-16)14-6-8-17-9-7-14/h6-9,12-13H,3-5,10-11H2,1-2H3/p+1/t12-,13-/m0/s1