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

Systemtic Name: 6-chloranyl-4-[3-(2H-1,2,3,4-tetrazol-5-yl)propyl]-1H-benzimidazole-2-carboxylic acid Openeye Name: 6-chloro-4-[3-(2H-tetrazol-5-yl)propyl]-1H-benzimidazole-2-carboxylic acid CAS Name: 6-chloro-4-[3-(2H-tetrazol-5-yl)propyl]-1H-benzimidazole-2-carboxylic acid IUPAC Name: 6-chloro-4-[3-(2H-tetrazol-5-yl)propyl]-1H-benzimidazole-2-carboxylic acid Traditional Name: 6-chloro-4-[3-(2H-tetrazol-5-yl)propyl]-1H-benzimidazole-2-carboxylic acid Formula: C12H11ClN6O2 MolecularWeight: 306.70774

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C2=C1NC(=N2)C(=O)O)CCCC3=NNN=N3)Cl

Isomeric SMILES

C1=C(C=C(C2=C1NC(=N2)C(=O)O)CCCC3=NNN=N3)Cl

InChI

InChI=1S/C12H11ClN6O2/c13-7-4-6(2-1-3-9-16-18-19-17-9)10-8(5-7)14-11(15-10)12(20)21/h4-5H,1-3H2,(H,14,15)(H,20,21)(H,16,17,18,19)