2-[methyl-(1-methylpiperidin-1-ium-4-yl)azaniumyl]ethanoate

Systemtic Name: 2-[methyl-(1-methylpiperidin-1-ium-4-yl)azaniumyl]ethanoate Openeye Name: 2-[methyl-(1-methylpiperidin-1-ium-4-yl)ammonio]acetate CAS Name: 2-[methyl-(1-methyl-4-piperidin-1-iumyl)ammonio]acetate IUPAC Name: 2-[methyl-(1-methylpiperidin-1-ium-4-yl)azaniumyl]acetate Traditional Name: 2-[methyl-(1-methylpiperidin-1-ium-4-yl)ammonio]acetate Formula: C9H19N2O2+ MolecularWeight: 187.25936

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)[NH+](C)CC(=O)[O-]

Isomeric SMILES

C[NH+]1CCC(CC1)[NH+](C)CC(=O)[O-]

InChI

InChI=1S/C9H18N2O2/c1-10-5-3-8(4-6-10)11(2)7-9(12)13/h8H,3-7H2,1-2H3,(H,12,13)/p+1