2-piperidin-1-ium-1-ylethyl 2-methylbutanoate

Systemtic Name: 2-piperidin-1-ium-1-ylethyl 2-methylbutanoate Openeye Name: 2-piperidin-1-ium-1-ylethyl 2-methylbutanoate CAS Name: 2-methylbutanoic acid 2-(1-piperidin-1-iumyl)ethyl ester IUPAC Name: 2-piperidin-1-ium-1-ylethyl 2-methylbutanoate Traditional Name: 2-methylbutyric acid 2-piperidin-1-ium-1-ylethyl ester Formula: C12H24NO2+ MolecularWeight: 214.32446

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(=O)OCC[NH+]1CCCCC1

Isomeric SMILES

CCC(C)C(=O)OCC[NH+]1CCCCC1

InChI

InChI=1S/C12H23NO2/c1-3-11(2)12(14)15-10-9-13-7-5-4-6-8-13/h11H,3-10H2,1-2H3/p+1