2-(1-tert-butyl-4-oxidanylidene-piperidin-1-ium-1-yl)propanoate

Systemtic Name: 2-(1-tert-butyl-4-oxidanylidene-piperidin-1-ium-1-yl)propanoate Openeye Name: 2-(1-tert-butyl-4-oxo-piperidin-1-ium-1-yl)propanoate CAS Name: 2-(1-tert-butyl-4-oxo-1-piperidin-1-iumyl)propanoate IUPAC Name: 2-(1-tert-butyl-4-oxopiperidin-1-ium-1-yl)propanoate Traditional Name: 2-(1-tert-butyl-4-keto-piperidin-1-ium-1-yl)propionate Formula: C12H21NO3 MolecularWeight: 227.30004

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)[O-])[N+]1(CCC(=O)CC1)C(C)(C)C

Isomeric SMILES

CC(C(=O)[O-])[N+]1(CCC(=O)CC1)C(C)(C)C

InChI

InChI=1S/C12H21NO3/c1-9(11(15)16)13(12(2,3)4)7-5-10(14)6-8-13/h9H,5-8H2,1-4H3