1-(carboxymethyl)-1-ethyl-imidazol-1-ium-4-carboxylic acid

Systemtic Name: 1-(carboxymethyl)-1-ethyl-imidazol-1-ium-4-carboxylic acid Openeye Name: 1-(carboxymethyl)-1-ethyl-imidazol-1-ium-4-carboxylic acid CAS Name: 1-(carboxymethyl)-1-ethyl-4-imidazol-1-iumcarboxylic acid IUPAC Name: 1-(carboxymethyl)-1-ethylimidazol-1-ium-4-carboxylic acid Traditional Name: 1-(carboxymethyl)-1-ethyl-imidazol-1-ium-4-carboxylic acid Formula: C8H11N2O4+ MolecularWeight: 199.18394

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1(C=C(N=C1)C(=O)O)CC(=O)O

Isomeric SMILES

CC[N+]1(C=C(N=C1)C(=O)O)CC(=O)O

InChI

InChI=1S/C8H10N2O4/c1-2-10(4-7(11)12)3-6(8(13)14)9-5-10/h3,5H,2,4H2,1H3,(H-,11,12,13,14)/p+1