3-(4-methylphenyl)-5-[(3S)-piperidin-1-ium-3-yl]-1,2,4-oxadiazole

Systemtic Name: 3-(4-methylphenyl)-5-[(3S)-piperidin-1-ium-3-yl]-1,2,4-oxadiazole Openeye Name: 5-[(3S)-piperidin-1-ium-3-yl]-3-(p-tolyl)-1,2,4-oxadiazole CAS Name: 3-(4-methylphenyl)-5-[(3S)-3-piperidin-1-iumyl]-1,2,4-oxadiazole IUPAC Name: 3-(4-methylphenyl)-5-[(3S)-piperidin-1-ium-3-yl]-1,2,4-oxadiazole Traditional Name: 5-[(3S)-piperidin-1-ium-3-yl]-3-(p-tolyl)-1,2,4-oxadiazole Formula: C14H18N3O+ MolecularWeight: 244.31222

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NOC(=N2)C3CCC[NH2+]C3

Isomeric SMILES

CC1=CC=C(C=C1)C2=NOC(=N2)[C@H]3CCC[NH2+]C3

InChI

InChI=1S/C14H17N3O/c1-10-4-6-11(7-5-10)13-16-14(18-17-13)12-3-2-8-15-9-12/h4-7,12,15H,2-3,8-9H2,1H3/p+1/t12-/m0/s1