2-(4-phenylpiperazin-1-yl)-5-[(2S)-pyrrolidin-1-ium-2-yl]-1,3,4-oxadiazole

Systemtic Name: 2-(4-phenylpiperazin-1-yl)-5-[(2S)-pyrrolidin-1-ium-2-yl]-1,3,4-oxadiazole Openeye Name: 2-(4-phenylpiperazin-1-yl)-5-[(2S)-pyrrolidin-1-ium-2-yl]-1,3,4-oxadiazole CAS Name: 2-(4-phenyl-1-piperazinyl)-5-[(2S)-2-pyrrolidin-1-iumyl]-1,3,4-oxadiazole IUPAC Name: 2-(4-phenylpiperazin-1-yl)-5-[(2S)-pyrrolidin-1-ium-2-yl]-1,3,4-oxadiazole Traditional Name: 2-(4-phenylpiperazino)-5-[(2S)-pyrrolidin-1-ium-2-yl]-1,3,4-oxadiazole Formula: C16H22N5O+ MolecularWeight: 300.37878

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Descriptors Computed from Structure

Canonical SMILES:

C1CC([NH2+]C1)C2=NN=C(O2)N3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

C1C[C@H]([NH2+]C1)C2=NN=C(O2)N3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C16H21N5O/c1-2-5-13(6-3-1)20-9-11-21(12-10-20)16-19-18-15(22-16)14-7-4-8-17-14/h1-3,5-6,14,17H,4,7-12H2/p+1/t14-/m0/s1