methyl (2S)-1-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl]pyrrolidin-1-ium-2-carboxylate

Systemtic Name: methyl (2S)-1-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl]pyrrolidin-1-ium-2-carboxylate Openeye Name: methyl (2S)-1-[[3-(2-thienyl)-1,2,4-oxadiazol-5-yl]methyl]pyrrolidin-1-ium-2-carboxylate CAS Name: (2S)-1-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl]-2-pyrrolidin-1-iumcarboxylic acid methyl ester IUPAC Name: methyl (2S)-1-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl]pyrrolidin-1-ium-2-carboxylate Traditional Name: (2S)-1-[[3-(2-thienyl)-1,2,4-oxadiazol-5-yl]methyl]pyrrolidin-1-ium-2-carboxylic acid methyl ester Formula: C13H16N3O3S+ MolecularWeight: 294.34944

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCC[NH+]1CC2=NC(=NO2)C3=CC=CS3

Isomeric SMILES

COC(=O)[C@@H]1CCC[NH+]1CC2=NC(=NO2)C3=CC=CS3

InChI

InChI=1S/C13H15N3O3S/c1-18-13(17)9-4-2-6-16(9)8-11-14-12(15-19-11)10-5-3-7-20-10/h3,5,7,9H,2,4,6,8H2,1H3/p+1/t9-/m0/s1