4-[[3-(1-phenylcyclobutyl)-1,2,4-oxadiazol-5-yl]methyl]piperazin-4-ium-2-one

Systemtic Name: 4-[[3-(1-phenylcyclobutyl)-1,2,4-oxadiazol-5-yl]methyl]piperazin-4-ium-2-one Openeye Name: 4-[[3-(1-phenylcyclobutyl)-1,2,4-oxadiazol-5-yl]methyl]piperazin-4-ium-2-one CAS Name: 4-[[3-(1-phenylcyclobutyl)-1,2,4-oxadiazol-5-yl]methyl]-2-piperazin-4-iumone IUPAC Name: 4-[[3-(1-phenylcyclobutyl)-1,2,4-oxadiazol-5-yl]methyl]piperazin-4-ium-2-one Traditional Name: 4-[[3-(1-phenylcyclobutyl)-1,2,4-oxadiazol-5-yl]methyl]piperazin-4-ium-2-one Formula: C17H21N4O2+ MolecularWeight: 313.37424

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)(C2=CC=CC=C2)C3=NOC(=N3)C[NH+]4CCNC(=O)C4

Isomeric SMILES

C1CC(C1)(C2=CC=CC=C2)C3=NOC(=N3)C[NH+]4CCNC(=O)C4

InChI

InChI=1S/C17H20N4O2/c22-14-11-21(10-9-18-14)12-15-19-16(20-23-15)17(7-4-8-17)13-5-2-1-3-6-13/h1-3,5-6H,4,7-12H2,(H,18,22)/p+1