2-[(2-nitrophenyl)methyl]-5-piperidin-1-ium-4-yl-1,3,4-oxadiazole

Systemtic Name: 2-[(2-nitrophenyl)methyl]-5-piperidin-1-ium-4-yl-1,3,4-oxadiazole Openeye Name: 2-[(2-nitrophenyl)methyl]-5-piperidin-1-ium-4-yl-1,3,4-oxadiazole CAS Name: 2-[(2-nitrophenyl)methyl]-5-(4-piperidin-1-iumyl)-1,3,4-oxadiazole IUPAC Name: 2-[(2-nitrophenyl)methyl]-5-piperidin-1-ium-4-yl-1,3,4-oxadiazole Traditional Name: 2-(2-nitrobenzyl)-5-piperidin-1-ium-4-yl-1,3,4-oxadiazole Formula: C14H17N4O3+ MolecularWeight: 289.30978

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH2+]CCC1C2=NN=C(O2)CC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

C1C[NH2+]CCC1C2=NN=C(O2)CC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C14H16N4O3/c19-18(20)12-4-2-1-3-11(12)9-13-16-17-14(21-13)10-5-7-15-8-6-10/h1-4,10,15H,5-9H2/p+1