3-(4-bromophenyl)-5-[(2S)-pyrrolidin-1-ium-2-yl]-1,2,4-oxadiazole

Systemtic Name: 3-(4-bromophenyl)-5-[(2S)-pyrrolidin-1-ium-2-yl]-1,2,4-oxadiazole Openeye Name: 3-(4-bromophenyl)-5-[(2S)-pyrrolidin-1-ium-2-yl]-1,2,4-oxadiazole CAS Name: 3-(4-bromophenyl)-5-[(2S)-2-pyrrolidin-1-iumyl]-1,2,4-oxadiazole IUPAC Name: 3-(4-bromophenyl)-5-[(2S)-pyrrolidin-1-ium-2-yl]-1,2,4-oxadiazole Traditional Name: 3-(4-bromophenyl)-5-[(2S)-pyrrolidin-1-ium-2-yl]-1,2,4-oxadiazole Formula: C12H13BrN3O+ MolecularWeight: 295.15512

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Descriptors Computed from Structure

Canonical SMILES:

C1CC([NH2+]C1)C2=NC(=NO2)C3=CC=C(C=C3)Br

Isomeric SMILES

C1C[C@H]([NH2+]C1)C2=NC(=NO2)C3=CC=C(C=C3)Br

InChI

InChI=1S/C12H12BrN3O/c13-9-5-3-8(4-6-9)11-15-12(17-16-11)10-2-1-7-14-10/h3-6,10,14H,1-2,7H2/p+1/t10-/m0/s1