(2S)-3-(1H-imidazol-5-yl)-2-[(2-oxidanylidene-1H-pyridin-3-yl)carbonylamino]propanoic acid

Systemtic Name: (2S)-3-(1H-imidazol-5-yl)-2-[(2-oxidanylidene-1H-pyridin-3-yl)carbonylamino]propanoic acid Openeye Name: (2S)-3-(1H-imidazol-5-yl)-2-[(2-oxo-1H-pyridine-3-carbonyl)amino]propanoic acid CAS Name: (2S)-3-(1H-imidazol-5-yl)-2-[[oxo-(2-oxo-1H-pyridin-3-yl)methyl]amino]propanoic acid IUPAC Name: (2S)-3-(1H-imidazol-5-yl)-2-[(2-oxo-1H-pyridine-3-carbonyl)amino]propanoic acid Traditional Name: (2S)-3-(1H-imidazol-5-yl)-2-[(2-keto-1H-pyridine-3-carbonyl)amino]propionic acid Formula: C12H12N4O4 MolecularWeight: 276.24808

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CNC(=O)C(=C1)C(=O)NC(CC2=CN=CN2)C(=O)O

Isomeric SMILES

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

InChI

InChI=1S/C12H12N4O4/c17-10-8(2-1-3-14-10)11(18)16-9(12(19)20)4-7-5-13-6-15-7/h1-3,5-6,9H,4H2,(H,13,15)(H,14,17)(H,16,18)(H,19,20)/t9-/m0/s1