2-[2-(6-carboxy-1H-benzimidazol-2-yl)ethyl]-3H-benzimidazole-5-carboxylic acid

Systemtic Name: 2-[2-(6-carboxy-1H-benzimidazol-2-yl)ethyl]-3H-benzimidazole-5-carboxylic acid Openeye Name: 2-[2-(6-carboxy-1H-benzimidazol-2-yl)ethyl]-3H-benzimidazole-5-carboxylic acid CAS Name: 2-[2-(6-carboxy-1H-benzimidazol-2-yl)ethyl]-3H-benzimidazole-5-carboxylic acid IUPAC Name: 2-[2-(6-carboxy-1H-benzimidazol-2-yl)ethyl]-3H-benzimidazole-5-carboxylic acid Traditional Name: 2-[2-(6-carboxy-1H-benzimidazol-2-yl)ethyl]-3H-benzimidazole-5-carboxylic acid Formula: C18H14N4O4 MolecularWeight: 350.32816

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1C(=O)O)NC(=N2)CCC3=NC4=C(N3)C=C(C=C4)C(=O)O

Isomeric SMILES

C1=CC2=C(C=C1C(=O)O)NC(=N2)CCC3=NC4=C(N3)C=C(C=C4)C(=O)O

InChI

InChI=1S/C18H14N4O4/c23-17(24)9-1-3-11-13(7-9)21-15(19-11)5-6-16-20-12-4-2-10(18(25)26)8-14(12)22-16/h1-4,7-8H,5-6H2,(H,19,21)(H,20,22)(H,23,24)(H,25,26)