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

Systemtic Name: 5-phenyl-3-(pyridin-1-ium-1-ylmethyl)-1,2,4-oxadiazole Openeye Name: 5-phenyl-3-(pyridin-1-ium-1-ylmethyl)-1,2,4-oxadiazole CAS Name: 5-phenyl-3-(1-pyridin-1-iumylmethyl)-1,2,4-oxadiazole IUPAC Name: 5-phenyl-3-(pyridin-1-ium-1-ylmethyl)-1,2,4-oxadiazole Traditional Name: 5-phenyl-3-(pyridin-1-ium-1-ylmethyl)-1,2,4-oxadiazole Formula: C14H12N3O+ MolecularWeight: 238.26458

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H12N3O/c1-3-7-12(8-4-1)14-15-13(16-18-14)11-17-9-5-2-6-10-17/h1-10H,11H2/q+1