ethyl (3R)-1-[(E)-2-methylbut-2-enyl]piperidin-1-ium-3-carboxylate

Systemtic Name: ethyl (3R)-1-[(E)-2-methylbut-2-enyl]piperidin-1-ium-3-carboxylate Openeye Name: ethyl (3R)-1-[(E)-2-methylbut-2-enyl]piperidin-1-ium-3-carboxylate CAS Name: (3R)-1-[(E)-2-methylbut-2-enyl]-3-piperidin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl (3R)-1-[(E)-2-methylbut-2-enyl]piperidin-1-ium-3-carboxylate Traditional Name: (3R)-1-[(E)-2-methylbut-2-enyl]piperidin-1-ium-3-carboxylic acid ethyl ester Formula: C13H24NO2+ MolecularWeight: 226.33516

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCC[NH+](C1)CC(=CC)C

Isomeric SMILES

CCOC(=O)[C@@H]1CCC[NH+](C1)C/C(=C/C)/C

InChI

InChI=1S/C13H23NO2/c1-4-11(3)9-14-8-6-7-12(10-14)13(15)16-5-2/h4,12H,5-10H2,1-3H3/p+1/b11-4+/t12-/m1/s1