3-(phenylmethyl)-5-[(1S)-1-piperazin-4-ium-1-ylethyl]-1,2,4-oxadiazole

Systemtic Name: 3-(phenylmethyl)-5-[(1S)-1-piperazin-4-ium-1-ylethyl]-1,2,4-oxadiazole Openeye Name: 3-benzyl-5-[(1S)-1-piperazin-4-ium-1-ylethyl]-1,2,4-oxadiazole CAS Name: 3-(phenylmethyl)-5-[(1S)-1-(1-piperazin-4-iumyl)ethyl]-1,2,4-oxadiazole IUPAC Name: 3-benzyl-5-[(1S)-1-piperazin-4-ium-1-ylethyl]-1,2,4-oxadiazole Traditional Name: 3-benzyl-5-[(1S)-1-piperazin-4-ium-1-ylethyl]-1,2,4-oxadiazole Formula: C15H21N4O+ MolecularWeight: 273.35344

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC(=NO1)CC2=CC=CC=C2)N3CC[NH2+]CC3

Isomeric SMILES

C[C@@H](C1=NC(=NO1)CC2=CC=CC=C2)N3CC[NH2+]CC3

InChI

InChI=1S/C15H20N4O/c1-12(19-9-7-16-8-10-19)15-17-14(18-20-15)11-13-5-3-2-4-6-13/h2-6,12,16H,7-11H2,1H3/p+1/t12-/m0/s1