1-(2-azanyl-2-oxidanylidene-ethyl)-2-propyl-benzimidazole-5-carboxylic acid

Systemtic Name: 1-(2-azanyl-2-oxidanylidene-ethyl)-2-propyl-benzimidazole-5-carboxylic acid Openeye Name: 1-(2-amino-2-oxo-ethyl)-2-propyl-benzimidazole-5-carboxylic acid CAS Name: 1-(2-amino-2-oxoethyl)-2-propyl-5-benzimidazolecarboxylic acid IUPAC Name: 1-(2-amino-2-oxoethyl)-2-propylbenzimidazole-5-carboxylic acid Traditional Name: 1-(2-amino-2-keto-ethyl)-2-propyl-benzimidazole-5-carboxylic acid Formula: C13H15N3O3 MolecularWeight: 261.2765

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC2=C(N1CC(=O)N)C=CC(=C2)C(=O)O

Isomeric SMILES

CCCC1=NC2=C(N1CC(=O)N)C=CC(=C2)C(=O)O

InChI

InChI=1S/C13H15N3O3/c1-2-3-12-15-9-6-8(13(18)19)4-5-10(9)16(12)7-11(14)17/h4-6H,2-3,7H2,1H3,(H2,14,17)(H,18,19)