3-(3-fluoranyl-4-methyl-phenyl)-5-[(2R)-pyrrolidin-1-ium-2-yl]-1,2,4-oxadiazole

Systemtic Name: 3-(3-fluoranyl-4-methyl-phenyl)-5-[(2R)-pyrrolidin-1-ium-2-yl]-1,2,4-oxadiazole Openeye Name: 3-(3-fluoro-4-methyl-phenyl)-5-[(2R)-pyrrolidin-1-ium-2-yl]-1,2,4-oxadiazole CAS Name: 3-(3-fluoro-4-methylphenyl)-5-[(2R)-2-pyrrolidin-1-iumyl]-1,2,4-oxadiazole IUPAC Name: 3-(3-fluoro-4-methylphenyl)-5-[(2R)-pyrrolidin-1-ium-2-yl]-1,2,4-oxadiazole Traditional Name: 3-(3-fluoro-4-methyl-phenyl)-5-[(2R)-pyrrolidin-1-ium-2-yl]-1,2,4-oxadiazole Formula: C13H15FN3O+ MolecularWeight: 248.276103

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NOC(=N2)C3CCC[NH2+]3)F

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NOC(=N2)[C@H]3CCC[NH2+]3)F

InChI

InChI=1S/C13H14FN3O/c1-8-4-5-9(7-10(8)14)12-16-13(18-17-12)11-3-2-6-15-11/h4-5,7,11,15H,2-3,6H2,1H3/p+1/t11-/m1/s1