methyl (2R)-2-cyano-2-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)ethanoate

Systemtic Name: methyl (2R)-2-cyano-2-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)ethanoate Openeye Name: methyl (2R)-2-cyano-2-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)acetate CAS Name: (2R)-2-cyano-2-(2,2,6,6-tetramethyl-4-piperidin-1-iumyl)acetic acid methyl ester IUPAC Name: methyl (2R)-2-cyano-2-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)acetate Traditional Name: (2R)-2-cyano-2-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)acetic acid methyl ester Formula: C13H23N2O2+ MolecularWeight: 239.33392

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(CC([NH2+]1)(C)C)C(C#N)C(=O)OC)C

Isomeric SMILES

CC1(CC(CC([NH2+]1)(C)C)[C@H](C#N)C(=O)OC)C

InChI

InChI=1S/C13H22N2O2/c1-12(2)6-9(7-13(3,4)15-12)10(8-14)11(16)17-5/h9-10,15H,6-7H2,1-5H3/p+1/t10-/m0/s1