methyl 3-piperidin-1-ium-1-ylpropanoate

Systemtic Name: methyl 3-piperidin-1-ium-1-ylpropanoate Openeye Name: methyl 3-piperidin-1-ium-1-ylpropanoate CAS Name: 3-(1-piperidin-1-iumyl)propanoic acid methyl ester IUPAC Name: methyl 3-piperidin-1-ium-1-ylpropanoate Traditional Name: 3-piperidin-1-ium-1-ylpropionic acid methyl ester Formula: C9H18NO2+ MolecularWeight: 172.24472

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC[NH+]1CCCCC1

Isomeric SMILES

COC(=O)CC[NH+]1CCCCC1

InChI

InChI=1S/C9H17NO2/c1-12-9(11)5-8-10-6-3-2-4-7-10/h2-8H2,1H3/p+1