4-(butylcarbamoyl)-5-methyl-1H-benzimidazole-2-carboxylic acid

Systemtic Name: 4-(butylcarbamoyl)-5-methyl-1H-benzimidazole-2-carboxylic acid Openeye Name: 4-(butylcarbamoyl)-5-methyl-1H-benzimidazole-2-carboxylic acid CAS Name: 4-[butylamino(oxo)methyl]-5-methyl-1H-benzimidazole-2-carboxylic acid IUPAC Name: 4-(butylcarbamoyl)-5-methyl-1H-benzimidazole-2-carboxylic acid Traditional Name: 4-(butylcarbamoyl)-5-methyl-1H-benzimidazole-2-carboxylic acid Formula: C14H17N3O3 MolecularWeight: 275.30308

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=C(C=CC2=C1N=C(N2)C(=O)O)C

Isomeric SMILES

CCCCNC(=O)C1=C(C=CC2=C1N=C(N2)C(=O)O)C

InChI

InChI=1S/C14H17N3O3/c1-3-4-7-15-13(18)10-8(2)5-6-9-11(10)17-12(16-9)14(19)20/h5-6H,3-4,7H2,1-2H3,(H,15,18)(H,16,17)(H,19,20)