3-[(3-fluorophenyl)methyl]-5-(pyrrolidin-1-ium-1-ylmethyl)-1,2,4-oxadiazole

Systemtic Name: 3-[(3-fluorophenyl)methyl]-5-(pyrrolidin-1-ium-1-ylmethyl)-1,2,4-oxadiazole Openeye Name: 3-[(3-fluorophenyl)methyl]-5-(pyrrolidin-1-ium-1-ylmethyl)-1,2,4-oxadiazole CAS Name: 3-[(3-fluorophenyl)methyl]-5-(1-pyrrolidin-1-iumylmethyl)-1,2,4-oxadiazole IUPAC Name: 3-[(3-fluorophenyl)methyl]-5-(pyrrolidin-1-ium-1-ylmethyl)-1,2,4-oxadiazole Traditional Name: 3-(3-fluorobenzyl)-5-(pyrrolidin-1-ium-1-ylmethyl)-1,2,4-oxadiazole Formula: C14H17FN3O+ MolecularWeight: 262.302683

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CC2=NC(=NO2)CC3=CC(=CC=C3)F

Isomeric SMILES

C1CC[NH+](C1)CC2=NC(=NO2)CC3=CC(=CC=C3)F

InChI

InChI=1S/C14H16FN3O/c15-12-5-3-4-11(8-12)9-13-16-14(19-17-13)10-18-6-1-2-7-18/h3-5,8H,1-2,6-7,9-10H2/p+1