(2S)-3-(1H-imidazol-5-yl)-2-[(2-oxidanidyl-4-oxidanylidene-1H-pyrimidin-6-yl)carbonylamino]propanoate

Systemtic Name: (2S)-3-(1H-imidazol-5-yl)-2-[(2-oxidanidyl-4-oxidanylidene-1H-pyrimidin-6-yl)carbonylamino]propanoate Openeye Name: (2S)-3-(1H-imidazol-5-yl)-2-[(2-oxido-4-oxo-1H-pyrimidine-6-carbonyl)amino]propanoate CAS Name: (2S)-3-(1H-imidazol-5-yl)-2-[[(2-oxido-4-oxo-1H-pyrimidin-6-yl)-oxomethyl]amino]propanoate IUPAC Name: (2S)-3-(1H-imidazol-5-yl)-2-[(2-oxido-4-oxo-1H-pyrimidine-6-carbonyl)amino]propanoate Traditional Name: (2S)-3-(1H-imidazol-5-yl)-2-[(4-keto-2-oxido-1H-pyrimidine-6-carbonyl)amino]propionate Formula: C11H9N5O5-2 MolecularWeight: 291.21966

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(NC(=NC1=O)[O-])C(=O)NC(CC2=CN=CN2)C(=O)[O-]

Isomeric SMILES

C1=C(NC(=NC1=O)[O-])C(=O)N[C@@H](CC2=CN=CN2)C(=O)[O-]

InChI

InChI=1S/C11H11N5O5/c17-8-2-6(15-11(21)16-8)9(18)14-7(10(19)20)1-5-3-12-4-13-5/h2-4,7H,1H2,(H,12,13)(H,14,18)(H,19,20)(H2,15,16,17,21)/p-2/t7-/m0/s1