(2S)-4-azanyl-2-(1,2-oxazol-5-ylcarbonylamino)-4-oxidanylidene-butanoate

Systemtic Name: (2S)-4-azanyl-2-(1,2-oxazol-5-ylcarbonylamino)-4-oxidanylidene-butanoate Openeye Name: (2S)-4-amino-2-(isoxazole-5-carbonylamino)-4-oxo-butanoate CAS Name: (2S)-4-amino-2-[[5-isoxazolyl(oxo)methyl]amino]-4-oxobutanoate IUPAC Name: (2S)-4-amino-2-(1,2-oxazole-5-carbonylamino)-4-oxobutanoate Traditional Name: (2S)-4-amino-2-(isoxazole-5-carbonylamino)-4-keto-butyrate Formula: C8H8N3O5- MolecularWeight: 226.16622

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(ON=C1)C(=O)NC(CC(=O)N)C(=O)[O-]

Isomeric SMILES

C1=C(ON=C1)C(=O)N[C@@H](CC(=O)N)C(=O)[O-]

InChI

InChI=1S/C8H9N3O5/c9-6(12)3-4(8(14)15)11-7(13)5-1-2-10-16-5/h1-2,4H,3H2,(H2,9,12)(H,11,13)(H,14,15)/p-1/t4-/m0/s1