2-[1-[2-(carboxymethyloxy)ethyl]-2-heptyl-4,5-dihydroimidazol-1-ium-1-yl]ethanoic acid

Systemtic Name: 2-[1-[2-(carboxymethyloxy)ethyl]-2-heptyl-4,5-dihydroimidazol-1-ium-1-yl]ethanoic acid Openeye Name: 2-[1-[2-(carboxymethyloxy)ethyl]-2-heptyl-4,5-dihydroimidazol-1-ium-1-yl]acetic acid CAS Name: 2-[1-[2-(carboxymethyloxy)ethyl]-2-heptyl-4,5-dihydroimidazol-1-ium-1-yl]acetic acid IUPAC Name: 2-[1-[2-(carboxymethyloxy)ethyl]-2-heptyl-4,5-dihydroimidazol-1-ium-1-yl]acetic acid Traditional Name: 2-[1-[2-(carboxymethyloxy)ethyl]-2-heptyl-2-imidazolin-1-ium-1-yl]acetic acid Formula: C16H29N2O5+ MolecularWeight: 329.41186

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=NCC[N+]1(CCOCC(=O)O)CC(=O)O

Isomeric SMILES

CCCCCCCC1=NCC[N+]1(CCOCC(=O)O)CC(=O)O

InChI

InChI=1S/C16H28N2O5/c1-2-3-4-5-6-7-14-17-8-9-18(14,12-15(19)20)10-11-23-13-16(21)22/h2-13H2,1H3,(H-,19,20,21,22)/p+1