2-[[(3S,5S)-3,5-dimethylpiperidin-1-ium-1-yl]methyl]-5-phenyl-1,3,4-oxadiazole

Systemtic Name: 2-[[(3S,5S)-3,5-dimethylpiperidin-1-ium-1-yl]methyl]-5-phenyl-1,3,4-oxadiazole Openeye Name: 2-[[(3S,5S)-3,5-dimethylpiperidin-1-ium-1-yl]methyl]-5-phenyl-1,3,4-oxadiazole CAS Name: 2-[[(3S,5S)-3,5-dimethyl-1-piperidin-1-iumyl]methyl]-5-phenyl-1,3,4-oxadiazole IUPAC Name: 2-[[(3S,5S)-3,5-dimethylpiperidin-1-ium-1-yl]methyl]-5-phenyl-1,3,4-oxadiazole Traditional Name: 2-[[(3S,5S)-3,5-dimethylpiperidin-1-ium-1-yl]methyl]-5-phenyl-1,3,4-oxadiazole Formula: C16H22N3O+ MolecularWeight: 272.36538

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(C[NH+](C1)CC2=NN=C(O2)C3=CC=CC=C3)C

Isomeric SMILES

C[C@H]1C[C@@H](C[NH+](C1)CC2=NN=C(O2)C3=CC=CC=C3)C

InChI

InChI=1S/C16H21N3O/c1-12-8-13(2)10-19(9-12)11-15-17-18-16(20-15)14-6-4-3-5-7-14/h3-7,12-13H,8-11H2,1-2H3/p+1/t12-,13-/m0/s1