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

Systemtic Name: 5-[[4-[(2-methoxyphenyl)methyl]piperazin-1-ium-1-yl]methyl]-3-phenyl-1,2,4-oxadiazole Openeye Name: 5-[[4-[(2-methoxyphenyl)methyl]piperazin-1-ium-1-yl]methyl]-3-phenyl-1,2,4-oxadiazole CAS Name: 5-[[4-[(2-methoxyphenyl)methyl]-1-piperazin-1-iumyl]methyl]-3-phenyl-1,2,4-oxadiazole IUPAC Name: 5-[[4-[(2-methoxyphenyl)methyl]piperazin-1-ium-1-yl]methyl]-3-phenyl-1,2,4-oxadiazole Traditional Name: 5-[(4-o-anisylpiperazin-1-ium-1-yl)methyl]-3-phenyl-1,2,4-oxadiazole Formula: C21H25N4O2+ MolecularWeight: 365.4488

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1CN2CC[NH+](CC2)CC3=NC(=NO3)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=CC=C1CN2CC[NH+](CC2)CC3=NC(=NO3)C4=CC=CC=C4

InChI

InChI=1S/C21H24N4O2/c1-26-19-10-6-5-9-18(19)15-24-11-13-25(14-12-24)16-20-22-21(23-27-20)17-7-3-2-4-8-17/h2-10H,11-16H2,1H3/p+1