5-piperidin-1-ium-1-ylpent-3-ynyl ethanoate

Systemtic Name: 5-piperidin-1-ium-1-ylpent-3-ynyl ethanoate Openeye Name: 5-piperidin-1-ium-1-ylpent-3-ynyl acetate CAS Name: acetic acid 5-(1-piperidin-1-iumyl)pent-3-ynyl ester IUPAC Name: 5-piperidin-1-ium-1-ylpent-3-ynyl acetate Traditional Name: acetic acid 5-piperidin-1-ium-1-ylpent-3-ynyl ester Formula: C12H20NO2+ MolecularWeight: 210.2927

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCCC#CC[NH+]1CCCCC1

Isomeric SMILES

CC(=O)OCCC#CC[NH+]1CCCCC1

InChI

InChI=1S/C12H19NO2/c1-12(14)15-11-7-3-6-10-13-8-4-2-5-9-13/h2,4-5,7-11H2,1H3/p+1