(2S)-3-methyl-2-[(2-oxidanidyl-6-oxidanylidene-1H-pyridin-4-yl)carbonylamino]butanoate

Systemtic Name: (2S)-3-methyl-2-[(2-oxidanidyl-6-oxidanylidene-1H-pyridin-4-yl)carbonylamino]butanoate Openeye Name: (2S)-3-methyl-2-[(2-oxido-6-oxo-1H-pyridine-4-carbonyl)amino]butanoate CAS Name: (2S)-3-methyl-2-[[(2-oxido-6-oxo-1H-pyridin-4-yl)-oxomethyl]amino]butanoate IUPAC Name: (2S)-3-methyl-2-[(2-oxido-6-oxo-1H-pyridine-4-carbonyl)amino]butanoate Traditional Name: (2S)-2-[(2-keto-6-oxido-1H-pyridine-4-carbonyl)amino]-3-methyl-butyrate Formula: C11H12N2O5-2 MolecularWeight: 252.22338

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H14N2O5/c1-5(2)9(11(17)18)13-10(16)6-3-7(14)12-8(15)4-6/h3-5,9H,1-2H3,(H,13,16)(H,17,18)(H2,12,14,15)/p-2/t9-/m0/s1