2-[furan-2-ylmethyl(propyl)azaniumyl]ethanoate

Systemtic Name: 2-[furan-2-ylmethyl(propyl)azaniumyl]ethanoate Openeye Name: 2-[2-furylmethyl(propyl)ammonio]acetate CAS Name: 2-[2-furanylmethyl(propyl)ammonio]acetate IUPAC Name: 2-[furan-2-ylmethyl(propyl)azaniumyl]acetate Traditional Name: 2-[2-furfuryl(propyl)ammonio]acetate Formula: C10H15NO3 MolecularWeight: 197.231

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+](CC1=CC=CO1)CC(=O)[O-]

Isomeric SMILES

CCC[NH+](CC1=CC=CO1)CC(=O)[O-]

InChI

InChI=1S/C10H15NO3/c1-2-5-11(8-10(12)13)7-9-4-3-6-14-9/h3-4,6H,2,5,7-8H2,1H3,(H,12,13)