3-cyclopropyl-5-[[(3S)-4-methyl-3-phenyl-piperazin-1-ium-1-yl]methyl]-1,2,4-oxadiazole

Systemtic Name: 3-cyclopropyl-5-[[(3S)-4-methyl-3-phenyl-piperazin-1-ium-1-yl]methyl]-1,2,4-oxadiazole Openeye Name: 3-cyclopropyl-5-[[(3S)-4-methyl-3-phenyl-piperazin-1-ium-1-yl]methyl]-1,2,4-oxadiazole CAS Name: 3-cyclopropyl-5-[[(3S)-4-methyl-3-phenyl-1-piperazin-1-iumyl]methyl]-1,2,4-oxadiazole IUPAC Name: 3-cyclopropyl-5-[[(3S)-4-methyl-3-phenylpiperazin-1-ium-1-yl]methyl]-1,2,4-oxadiazole Traditional Name: 3-cyclopropyl-5-[[(3S)-4-methyl-3-phenyl-piperazin-1-ium-1-yl]methyl]-1,2,4-oxadiazole Formula: C17H23N4O+ MolecularWeight: 299.39072

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC[NH+](CC1C2=CC=CC=C2)CC3=NC(=NO3)C4CC4

Isomeric SMILES

CN1CC[NH+](C[C@@H]1C2=CC=CC=C2)CC3=NC(=NO3)C4CC4

InChI

InChI=1S/C17H22N4O/c1-20-9-10-21(11-15(20)13-5-3-2-4-6-13)12-16-18-17(19-22-16)14-7-8-14/h2-6,14-15H,7-12H2,1H3/p+1/t15-/m1/s1