methyl 1,1-dimethyl-4-oxidanyl-piperidin-1-ium-3-carboxylate iodide

Systemtic Name: methyl 1,1-dimethyl-4-oxidanyl-piperidin-1-ium-3-carboxylate iodide Openeye Name: methyl 4-hydroxy-1,1-dimethyl-piperidin-1-ium-3-carboxylate iodide CAS Name: 4-hydroxy-1,1-dimethyl-3-piperidin-1-iumcarboxylic acid methyl ester iodide IUPAC Name: methyl 4-hydroxy-1,1-dimethylpiperidin-1-ium-3-carboxylate iodide Traditional Name: 4-hydroxy-1,1-dimethyl-piperidin-1-ium-3-carboxylic acid methyl ester iodide Formula: C9H18INO3 MolecularWeight: 315.14859

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCC(C(C1)C(=O)OC)O)C.[I-]

Isomeric SMILES

C[N+]1(CCC(C(C1)C(=O)OC)O)C.[I-]

InChI

InChI=1S/C9H18NO3.HI/c1-10(2)5-4-8(11)7(6-10)9(12)13-3;/h7-8,11H,4-6H2,1-3H3;1H/q+1;/p-1