3-(4-methylphenyl)-5-(piperidin-1-ium-1-ylmethyl)-1,2,4-oxadiazole

Systemtic Name: 3-(4-methylphenyl)-5-(piperidin-1-ium-1-ylmethyl)-1,2,4-oxadiazole Openeye Name: 5-(piperidin-1-ium-1-ylmethyl)-3-(p-tolyl)-1,2,4-oxadiazole CAS Name: 3-(4-methylphenyl)-5-(1-piperidin-1-iumylmethyl)-1,2,4-oxadiazole IUPAC Name: 3-(4-methylphenyl)-5-(piperidin-1-ium-1-ylmethyl)-1,2,4-oxadiazole Traditional Name: 5-(piperidin-1-ium-1-ylmethyl)-3-(p-tolyl)-1,2,4-oxadiazole Formula: C15H20N3O+ MolecularWeight: 258.3388

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NOC(=N2)C[NH+]3CCCCC3

Isomeric SMILES

CC1=CC=C(C=C1)C2=NOC(=N2)C[NH+]3CCCCC3

InChI

InChI=1S/C15H19N3O/c1-12-5-7-13(8-6-12)15-16-14(19-17-15)11-18-9-3-2-4-10-18/h5-8H,2-4,9-11H2,1H3/p+1