3-methyl-5-[[2-(2-pyrrolidin-1-ium-1-ylethoxy)phenoxy]methyl]-1,2,4-oxadiazole

Systemtic Name: 3-methyl-5-[[2-(2-pyrrolidin-1-ium-1-ylethoxy)phenoxy]methyl]-1,2,4-oxadiazole Openeye Name: 3-methyl-5-[[2-(2-pyrrolidin-1-ium-1-ylethoxy)phenoxy]methyl]-1,2,4-oxadiazole CAS Name: 3-methyl-5-[[2-[2-(1-pyrrolidin-1-iumyl)ethoxy]phenoxy]methyl]-1,2,4-oxadiazole IUPAC Name: 3-methyl-5-[[2-(2-pyrrolidin-1-ium-1-ylethoxy)phenoxy]methyl]-1,2,4-oxadiazole Traditional Name: 3-methyl-5-[[2-(2-pyrrolidin-1-ium-1-ylethoxy)phenoxy]methyl]-1,2,4-oxadiazole Formula: C16H22N3O3+ MolecularWeight: 304.36418

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=N1)COC2=CC=CC=C2OCC[NH+]3CCCC3

Isomeric SMILES

CC1=NOC(=N1)COC2=CC=CC=C2OCC[NH+]3CCCC3

InChI

InChI=1S/C16H21N3O3/c1-13-17-16(22-18-13)12-21-15-7-3-2-6-14(15)20-11-10-19-8-4-5-9-19/h2-3,6-7H,4-5,8-12H2,1H3/p+1