methyl 1-methyl-4-oxidanylidene-piperidin-1-ium-3-carboxylate

Systemtic Name: methyl 1-methyl-4-oxidanylidene-piperidin-1-ium-3-carboxylate Openeye Name: methyl 1-methyl-4-oxo-piperidin-1-ium-3-carboxylate CAS Name: 1-methyl-4-oxo-3-piperidin-1-iumcarboxylic acid methyl ester IUPAC Name: methyl 1-methyl-4-oxopiperidin-1-ium-3-carboxylate Traditional Name: 4-keto-1-methyl-piperidin-1-ium-3-carboxylic acid methyl ester Formula: C8H14NO3+ MolecularWeight: 172.20166

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(=O)C(C1)C(=O)OC

Isomeric SMILES

C[NH+]1CCC(=O)C(C1)C(=O)OC

InChI

InChI=1S/C8H13NO3/c1-9-4-3-7(10)6(5-9)8(11)12-2/h6H,3-5H2,1-2H3/p+1