ethyl (2R)-2-(ethylsulfanylmethyl)-3-morpholin-4-ium-4-yl-propanoate

Systemtic Name: ethyl (2R)-2-(ethylsulfanylmethyl)-3-morpholin-4-ium-4-yl-propanoate Openeye Name: ethyl (2R)-2-(ethylsulfanylmethyl)-3-morpholin-4-ium-4-yl-propanoate CAS Name: (2R)-2-[(ethylthio)methyl]-3-(4-morpholin-4-iumyl)propanoic acid ethyl ester IUPAC Name: ethyl (2R)-2-(ethylsulfanylmethyl)-3-morpholin-4-ium-4-ylpropanoate Traditional Name: (2R)-2-[(ethylthio)methyl]-3-morpholin-4-ium-4-yl-propionic acid ethyl ester Formula: C12H24NO3S+ MolecularWeight: 262.38886

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C[NH+]1CCOCC1)CSCC

Isomeric SMILES

CCOC(=O)[C@@H](C[NH+]1CCOCC1)CSCC

InChI

InChI=1S/C12H23NO3S/c1-3-16-12(14)11(10-17-4-2)9-13-5-7-15-8-6-13/h11H,3-10H2,1-2H3/p+1/t11-/m0/s1