4-azanyl-2-[2-(benzimidazol-1-yl)ethanoylamino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-azanyl-2-[2-(benzimidazol-1-yl)ethanoylamino]-4-oxidanylidene-butanoic acid Openeye Name: 4-amino-2-[[2-(benzimidazol-1-yl)acetyl]amino]-4-oxo-butanoic acid CAS Name: 4-amino-2-[[2-(1-benzimidazolyl)-1-oxoethyl]amino]-4-oxobutanoic acid IUPAC Name: 4-amino-2-[[2-(benzimidazol-1-yl)acetyl]amino]-4-oxobutanoic acid Traditional Name: 4-amino-2-[[2-(benzimidazol-1-yl)acetyl]amino]-4-keto-butyric acid Formula: C13H14N4O4 MolecularWeight: 290.27466

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=CN2CC(=O)NC(CC(=O)N)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)N=CN2CC(=O)NC(CC(=O)N)C(=O)O

InChI

InChI=1S/C13H14N4O4/c14-11(18)5-9(13(20)21)16-12(19)6-17-7-15-8-3-1-2-4-10(8)17/h1-4,7,9H,5-6H2,(H2,14,18)(H,16,19)(H,20,21)