5-butanoyl-1-ethyl-6-methyl-benzimidazole-2-carboxylic acid

Systemtic Name: 5-butanoyl-1-ethyl-6-methyl-benzimidazole-2-carboxylic acid Openeye Name: 5-butanoyl-1-ethyl-6-methyl-benzimidazole-2-carboxylic acid CAS Name: 1-ethyl-6-methyl-5-(1-oxobutyl)-2-benzimidazolecarboxylic acid IUPAC Name: 5-butanoyl-1-ethyl-6-methylbenzimidazole-2-carboxylic acid Traditional Name: 5-butyryl-1-ethyl-6-methyl-benzimidazole-2-carboxylic acid Formula: C15H18N2O3 MolecularWeight: 274.31502

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C1=CC2=C(C=C1C)N(C(=N2)C(=O)O)CC

Isomeric SMILES

CCCC(=O)C1=CC2=C(C=C1C)N(C(=N2)C(=O)O)CC

InChI

InChI=1S/C15H18N2O3/c1-4-6-13(18)10-8-11-12(7-9(10)3)17(5-2)14(16-11)15(19)20/h7-8H,4-6H2,1-3H3,(H,19,20)