4-[3-(2H-1,2,3,4-tetrazol-5-yl)propyl]-1H-benzimidazole-2-carboxylic acid

Systemtic Name: 4-[3-(2H-1,2,3,4-tetrazol-5-yl)propyl]-1H-benzimidazole-2-carboxylic acid Openeye Name: 4-[3-(2H-tetrazol-5-yl)propyl]-1H-benzimidazole-2-carboxylic acid CAS Name: 4-[3-(2H-tetrazol-5-yl)propyl]-1H-benzimidazole-2-carboxylic acid IUPAC Name: 4-[3-(2H-tetrazol-5-yl)propyl]-1H-benzimidazole-2-carboxylic acid Traditional Name: 4-[3-(2H-tetrazol-5-yl)propyl]-1H-benzimidazole-2-carboxylic acid Formula: C12H12N6O2 MolecularWeight: 272.26268

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C2C(=C1)NC(=N2)C(=O)O)CCCC3=NNN=N3

Isomeric SMILES

C1=CC(=C2C(=C1)NC(=N2)C(=O)O)CCCC3=NNN=N3

InChI

InChI=1S/C12H12N6O2/c19-12(20)11-13-8-5-1-3-7(10(8)14-11)4-2-6-9-15-17-18-16-9/h1,3,5H,2,4,6H2,(H,13,14)(H,19,20)(H,15,16,17,18)