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

Systemtic Name: 3-(4-chlorophenyl)-5-[[(3S)-3-methoxypiperidin-1-ium-1-yl]methyl]-1,2,4-oxadiazole Openeye Name: 3-(4-chlorophenyl)-5-[[(3S)-3-methoxypiperidin-1-ium-1-yl]methyl]-1,2,4-oxadiazole CAS Name: 3-(4-chlorophenyl)-5-[[(3S)-3-methoxy-1-piperidin-1-iumyl]methyl]-1,2,4-oxadiazole IUPAC Name: 3-(4-chlorophenyl)-5-[[(3S)-3-methoxypiperidin-1-ium-1-yl]methyl]-1,2,4-oxadiazole Traditional Name: 3-(4-chlorophenyl)-5-[[(3S)-3-methoxypiperidin-1-ium-1-yl]methyl]-1,2,4-oxadiazole Formula: C15H19ClN3O2+ MolecularWeight: 308.78326

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Descriptors Computed from Structure

Canonical SMILES:

COC1CCC[NH+](C1)CC2=NC(=NO2)C3=CC=C(C=C3)Cl

Isomeric SMILES

CO[C@H]1CCC[NH+](C1)CC2=NC(=NO2)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C15H18ClN3O2/c1-20-13-3-2-8-19(9-13)10-14-17-15(18-21-14)11-4-6-12(16)7-5-11/h4-7,13H,2-3,8-10H2,1H3/p+1/t13-/m0/s1