2-[(2R)-2-(4,5-dimethylthiophen-2-yl)pyrrolidin-1-ium-1-yl]ethanoate

Systemtic Name: 2-[(2R)-2-(4,5-dimethylthiophen-2-yl)pyrrolidin-1-ium-1-yl]ethanoate Openeye Name: 2-[(2R)-2-(4,5-dimethyl-2-thienyl)pyrrolidin-1-ium-1-yl]acetate CAS Name: 2-[(2R)-2-(4,5-dimethyl-2-thiophenyl)-1-pyrrolidin-1-iumyl]acetate IUPAC Name: 2-[(2R)-2-(4,5-dimethylthiophen-2-yl)pyrrolidin-1-ium-1-yl]acetate Traditional Name: 2-[(2R)-2-(4,5-dimethyl-2-thienyl)pyrrolidin-1-ium-1-yl]acetate Formula: C12H17NO2S MolecularWeight: 239.33388

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1)C2CCC[NH+]2CC(=O)[O-])C

Isomeric SMILES

CC1=C(SC(=C1)[C@H]2CCC[NH+]2CC(=O)[O-])C

InChI

InChI=1S/C12H17NO2S/c1-8-6-11(16-9(8)2)10-4-3-5-13(10)7-12(14)15/h6,10H,3-5,7H2,1-2H3,(H,14,15)/t10-/m1/s1