1-butyl-2-methyl-benzimidazole-5-carboxylic acid

Systemtic Name: 1-butyl-2-methyl-benzimidazole-5-carboxylic acid Openeye Name: 1-butyl-2-methyl-benzimidazole-5-carboxylic acid CAS Name: 1-butyl-2-methyl-5-benzimidazolecarboxylic acid IUPAC Name: 1-butyl-2-methylbenzimidazole-5-carboxylic acid Traditional Name: 1-butyl-2-methyl-benzimidazole-5-carboxylic acid Formula: C13H16N2O2 MolecularWeight: 232.27834

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=NC2=C1C=CC(=C2)C(=O)O)C

Isomeric SMILES

CCCCN1C(=NC2=C1C=CC(=C2)C(=O)O)C

InChI

InChI=1S/C13H16N2O2/c1-3-4-7-15-9(2)14-11-8-10(13(16)17)5-6-12(11)15/h5-6,8H,3-4,7H2,1-2H3,(H,16,17)