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

Systemtic Name: 5-(4-methylphenyl)-3-(pyridin-1-ium-1-ylmethyl)-1,2,4-oxadiazole Openeye Name: 5-(p-tolyl)-3-(pyridin-1-ium-1-ylmethyl)-1,2,4-oxadiazole CAS Name: 5-(4-methylphenyl)-3-(1-pyridin-1-iumylmethyl)-1,2,4-oxadiazole IUPAC Name: 5-(4-methylphenyl)-3-(pyridin-1-ium-1-ylmethyl)-1,2,4-oxadiazole Traditional Name: 5-(p-tolyl)-3-(pyridin-1-ium-1-ylmethyl)-1,2,4-oxadiazole Formula: C15H14N3O+ MolecularWeight: 252.29116

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=NO2)C[N+]3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=NO2)C[N+]3=CC=CC=C3

InChI

InChI=1S/C15H14N3O/c1-12-5-7-13(8-6-12)15-16-14(17-19-15)11-18-9-3-2-4-10-18/h2-10H,11H2,1H3/q+1