4-[3-(1H-benzimidazol-2-yl)propanoylamino]butanoic acid

Systemtic Name: 4-[3-(1H-benzimidazol-2-yl)propanoylamino]butanoic acid Openeye Name: 4-[3-(1H-benzimidazol-2-yl)propanoylamino]butanoic acid CAS Name: 4-[[3-(1H-benzimidazol-2-yl)-1-oxopropyl]amino]butanoic acid IUPAC Name: 4-[3-(1H-benzimidazol-2-yl)propanoylamino]butanoic acid Traditional Name: 4-[3-(1H-benzimidazol-2-yl)propanoylamino]butyric acid Formula: C14H17N3O3 MolecularWeight: 275.30308

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=N2)CCC(=O)NCCCC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)NC(=N2)CCC(=O)NCCCC(=O)O

InChI

InChI=1S/C14H17N3O3/c18-13(15-9-3-6-14(19)20)8-7-12-16-10-4-1-2-5-11(10)17-12/h1-2,4-5H,3,6-9H2,(H,15,18)(H,16,17)(H,19,20)