1-[3-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)-1,3-thiazol-3-ium-2-yl]ethyl ethanoate

Systemtic Name: 1-[3-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)-1,3-thiazol-3-ium-2-yl]ethyl ethanoate Openeye Name: 1-[3-(2-oxo-2-pyrrolidin-1-yl-ethyl)thiazol-3-ium-2-yl]ethyl acetate CAS Name: acetic acid 1-[3-[2-oxo-2-(1-pyrrolidinyl)ethyl]-2-thiazol-3-iumyl]ethyl ester IUPAC Name: 1-[3-(2-oxo-2-pyrrolidin-1-ylethyl)-1,3-thiazol-3-ium-2-yl]ethyl acetate Traditional Name: acetic acid 1-[3-(2-keto-2-pyrrolidino-ethyl)thiazol-3-ium-2-yl]ethyl ester Formula: C13H19N2O3S+ MolecularWeight: 283.36656

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=[N+](C=CS1)CC(=O)N2CCCC2)OC(=O)C

Isomeric SMILES

CC(C1=[N+](C=CS1)CC(=O)N2CCCC2)OC(=O)C

InChI

InChI=1S/C13H19N2O3S/c1-10(18-11(2)16)13-15(7-8-19-13)9-12(17)14-5-3-4-6-14/h7-8,10H,3-6,9H2,1-2H3/q+1