2-(2-pyrrolidin-1-ium-1-ylethylsulfanyl)ethanoate

Systemtic Name: 2-(2-pyrrolidin-1-ium-1-ylethylsulfanyl)ethanoate Openeye Name: 2-(2-pyrrolidin-1-ium-1-ylethylsulfanyl)acetate CAS Name: 2-[2-(1-pyrrolidin-1-iumyl)ethylthio]acetate IUPAC Name: 2-(2-pyrrolidin-1-ium-1-ylethylsulfanyl)acetate Traditional Name: 2-(2-pyrrolidin-1-ium-1-ylethylthio)acetate Formula: C8H15NO2S MolecularWeight: 189.2752

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CCSCC(=O)[O-]

Isomeric SMILES

C1CC[NH+](C1)CCSCC(=O)[O-]

InChI

InChI=1S/C8H15NO2S/c10-8(11)7-12-6-5-9-3-1-2-4-9/h1-7H2,(H,10,11)