6-azanyl-6-(2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)hexanoic acid

Systemtic Name: 6-azanyl-6-(2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)hexanoic acid Openeye Name: 6-amino-6-(2-oxo-1,3-dihydrobenzimidazol-5-yl)hexanoic acid CAS Name: 6-amino-6-(2-oxo-1,3-dihydrobenzimidazol-5-yl)hexanoic acid IUPAC Name: 6-amino-6-(2-oxo-1,3-dihydrobenzimidazol-5-yl)hexanoic acid Traditional Name: 6-amino-6-(2-keto-1,3-dihydrobenzimidazol-5-yl)hexanoic acid Formula: C13H17N3O3 MolecularWeight: 263.29238

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17N3O3/c14-9(3-1-2-4-12(17)18)8-5-6-10-11(7-8)16-13(19)15-10/h5-7,9H,1-4,14H2,(H,17,18)(H2,15,16,19)