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

Systemtic Name: 5-[(2S,4R)-4-methoxypyrrolidin-1-ium-2-yl]-3-(2-phenoxyethyl)-1,2,4-oxadiazole Openeye Name: 5-[(2S,4R)-4-methoxypyrrolidin-1-ium-2-yl]-3-(2-phenoxyethyl)-1,2,4-oxadiazole CAS Name: 5-[(2S,4R)-4-methoxy-2-pyrrolidin-1-iumyl]-3-(2-phenoxyethyl)-1,2,4-oxadiazole IUPAC Name: 5-[(2S,4R)-4-methoxypyrrolidin-1-ium-2-yl]-3-(2-phenoxyethyl)-1,2,4-oxadiazole Traditional Name: 5-[(2S,4R)-4-methoxypyrrolidin-1-ium-2-yl]-3-(2-phenoxyethyl)-1,2,4-oxadiazole Formula: C15H20N3O3+ MolecularWeight: 290.3376

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Descriptors Computed from Structure

Canonical SMILES:

COC1CC([NH2+]C1)C2=NC(=NO2)CCOC3=CC=CC=C3

Isomeric SMILES

CO[C@@H]1C[C@H]([NH2+]C1)C2=NC(=NO2)CCOC3=CC=CC=C3

InChI

InChI=1S/C15H19N3O3/c1-19-12-9-13(16-10-12)15-17-14(18-21-15)7-8-20-11-5-3-2-4-6-11/h2-6,12-13,16H,7-10H2,1H3/p+1/t12-,13+/m1/s1