2-ethylbenzimidazol-3-ium-1,3-dicarboxylic acid

Systemtic Name: 2-ethylbenzimidazol-3-ium-1,3-dicarboxylic acid Openeye Name: 2-ethylbenzimidazol-3-ium-1,3-dicarboxylic acid CAS Name: 2-ethylbenzimidazol-3-ium-1,3-dicarboxylic acid IUPAC Name: 2-ethylbenzimidazol-3-ium-1,3-dicarboxylic acid Traditional Name: 2-ethylbenzimidazol-3-ium-1,3-dicarboxylic acid Formula: C11H11N2O4+ MolecularWeight: 235.21604

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=[N+](C2=CC=CC=C2N1C(=O)O)C(=O)O

Isomeric SMILES

CCC1=[N+](C2=CC=CC=C2N1C(=O)O)C(=O)O

InChI

InChI=1S/C11H10N2O4/c1-2-9-12(10(14)15)7-5-3-4-6-8(7)13(9)11(16)17/h3-6H,2H2,1H3,(H-,14,15,16,17)/p+1