5-[(2S,4R)-4-methoxypyrrolidin-1-ium-2-yl]-3-(2-methylpropyl)-1,2,4-oxadiazole

Systemtic Name: 5-[(2S,4R)-4-methoxypyrrolidin-1-ium-2-yl]-3-(2-methylpropyl)-1,2,4-oxadiazole Openeye Name: 3-isobutyl-5-[(2S,4R)-4-methoxypyrrolidin-1-ium-2-yl]-1,2,4-oxadiazole CAS Name: 5-[(2S,4R)-4-methoxy-2-pyrrolidin-1-iumyl]-3-(2-methylpropyl)-1,2,4-oxadiazole IUPAC Name: 5-[(2S,4R)-4-methoxypyrrolidin-1-ium-2-yl]-3-(2-methylpropyl)-1,2,4-oxadiazole Traditional Name: 3-isobutyl-5-[(2S,4R)-4-methoxypyrrolidin-1-ium-2-yl]-1,2,4-oxadiazole Formula: C11H20N3O2+ MolecularWeight: 226.2954

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=NOC(=N1)C2CC(C[NH2+]2)OC

Isomeric SMILES

CC(C)CC1=NOC(=N1)[C@@H]2C[C@H](C[NH2+]2)OC

InChI

InChI=1S/C11H19N3O2/c1-7(2)4-10-13-11(16-14-10)9-5-8(15-3)6-12-9/h7-9,12H,4-6H2,1-3H3/p+1/t8-,9+/m1/s1