(2S)-3-(1H-imidazol-5-yl)-2-(2-pyridin-4-ylethanoylamino)propanoic acid

Systemtic Name: (2S)-3-(1H-imidazol-5-yl)-2-(2-pyridin-4-ylethanoylamino)propanoic acid Openeye Name: (2S)-3-(1H-imidazol-5-yl)-2-[[2-(4-pyridyl)acetyl]amino]propanoic acid CAS Name: (2S)-3-(1H-imidazol-5-yl)-2-[(1-oxo-2-pyridin-4-ylethyl)amino]propanoic acid IUPAC Name: (2S)-3-(1H-imidazol-5-yl)-2-[(2-pyridin-4-ylacetyl)amino]propanoic acid Traditional Name: (2S)-3-(1H-imidazol-5-yl)-2-[[2-(4-pyridyl)acetyl]amino]propionic acid Formula: C13H14N4O3 MolecularWeight: 274.27526

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=CC=C1CC(=O)NC(CC2=CN=CN2)C(=O)O

Isomeric SMILES

C1=CN=CC=C1CC(=O)N[C@@H](CC2=CN=CN2)C(=O)O

InChI

InChI=1S/C13H14N4O3/c18-12(5-9-1-3-14-4-2-9)17-11(13(19)20)6-10-7-15-8-16-10/h1-4,7-8,11H,5-6H2,(H,15,16)(H,17,18)(H,19,20)/t11-/m0/s1