6-methyl-5-pentanoyl-1H-benzimidazole-2-carboxylic acid

Systemtic Name: 6-methyl-5-pentanoyl-1H-benzimidazole-2-carboxylic acid Openeye Name: 6-methyl-5-pentanoyl-1H-benzimidazole-2-carboxylic acid CAS Name: 6-methyl-5-(1-oxopentyl)-1H-benzimidazole-2-carboxylic acid IUPAC Name: 6-methyl-5-pentanoyl-1H-benzimidazole-2-carboxylic acid Traditional Name: 6-methyl-5-valeryl-1H-benzimidazole-2-carboxylic acid Formula: C14H16N2O3 MolecularWeight: 260.28844

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)C1=CC2=C(C=C1C)NC(=N2)C(=O)O

Isomeric SMILES

CCCCC(=O)C1=CC2=C(C=C1C)NC(=N2)C(=O)O

InChI

InChI=1S/C14H16N2O3/c1-3-4-5-12(17)9-7-11-10(6-8(9)2)15-13(16-11)14(18)19/h6-7H,3-5H2,1-2H3,(H,15,16)(H,18,19)