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

Systemtic Name: 1-butyl-5-ethanoyl-benzimidazole-2-carboxylic acid Openeye Name: 5-acetyl-1-butyl-benzimidazole-2-carboxylic acid CAS Name: 5-acetyl-1-butyl-2-benzimidazolecarboxylic acid IUPAC Name: 5-acetyl-1-butylbenzimidazole-2-carboxylic acid Traditional Name: 5-acetyl-1-butyl-benzimidazole-2-carboxylic acid Formula: C14H16N2O3 MolecularWeight: 260.28844

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=C(C=C2)C(=O)C)N=C1C(=O)O

Isomeric SMILES

CCCCN1C2=C(C=C(C=C2)C(=O)C)N=C1C(=O)O

InChI

InChI=1S/C14H16N2O3/c1-3-4-7-16-12-6-5-10(9(2)17)8-11(12)15-13(16)14(18)19/h5-6,8H,3-4,7H2,1-2H3,(H,18,19)