2-[2-[(1S)-1-pyrrolidin-1-ium-1-ylethyl]-1,3-thiazol-4-yl]ethanoate

Systemtic Name: 2-[2-[(1S)-1-pyrrolidin-1-ium-1-ylethyl]-1,3-thiazol-4-yl]ethanoate Openeye Name: 2-[2-[(1S)-1-pyrrolidin-1-ium-1-ylethyl]thiazol-4-yl]acetate CAS Name: 2-[2-[(1S)-1-(1-pyrrolidin-1-iumyl)ethyl]-4-thiazolyl]acetate IUPAC Name: 2-[2-[(1S)-1-pyrrolidin-1-ium-1-ylethyl]-1,3-thiazol-4-yl]acetate Traditional Name: 2-[2-[(1S)-1-pyrrolidin-1-ium-1-ylethyl]thiazol-4-yl]acetate Formula: C11H16N2O2S MolecularWeight: 240.32194

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC(=CS1)CC(=O)[O-])[NH+]2CCCC2

Isomeric SMILES

C[C@@H](C1=NC(=CS1)CC(=O)[O-])[NH+]2CCCC2

InChI

InChI=1S/C11H16N2O2S/c1-8(13-4-2-3-5-13)11-12-9(7-16-11)6-10(14)15/h7-8H,2-6H2,1H3,(H,14,15)/t8-/m0/s1