2-phenyl-5-[(1R)-1-[4-(phenylmethyl)piperazin-1-ium-1-yl]ethyl]-1,3,4-oxadiazole

Systemtic Name: 2-phenyl-5-[(1R)-1-[4-(phenylmethyl)piperazin-1-ium-1-yl]ethyl]-1,3,4-oxadiazole Openeye Name: 2-[(1R)-1-(4-benzylpiperazin-1-ium-1-yl)ethyl]-5-phenyl-1,3,4-oxadiazole CAS Name: 2-phenyl-5-[(1R)-1-[4-(phenylmethyl)-1-piperazin-1-iumyl]ethyl]-1,3,4-oxadiazole IUPAC Name: 2-[(1R)-1-(4-benzylpiperazin-1-ium-1-yl)ethyl]-5-phenyl-1,3,4-oxadiazole Traditional Name: 2-[(1R)-1-(4-benzylpiperazin-1-ium-1-yl)ethyl]-5-phenyl-1,3,4-oxadiazole Formula: C21H25N4O+ MolecularWeight: 349.4494

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NN=C(O1)C2=CC=CC=C2)[NH+]3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

C[C@H](C1=NN=C(O1)C2=CC=CC=C2)[NH+]3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C21H24N4O/c1-17(20-22-23-21(26-20)19-10-6-3-7-11-19)25-14-12-24(13-15-25)16-18-8-4-2-5-9-18/h2-11,17H,12-16H2,1H3/p+1/t17-/m1/s1