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

Systemtic Name: (2S,3S)-3-methyl-2-[(2-oxidanidyl-6-oxidanylidene-1H-pyridin-4-yl)carbonylamino]pentanoate Openeye Name: (2S,3S)-3-methyl-2-[(2-oxido-6-oxo-1H-pyridine-4-carbonyl)amino]pentanoate CAS Name: (2S,3S)-3-methyl-2-[[(2-oxido-6-oxo-1H-pyridin-4-yl)-oxomethyl]amino]pentanoate IUPAC Name: (2S,3S)-3-methyl-2-[(2-oxido-6-oxo-1H-pyridine-4-carbonyl)amino]pentanoate Traditional Name: (2S,3S)-2-[(2-keto-6-oxido-1H-pyridine-4-carbonyl)amino]-3-methyl-valerate Formula: C12H14N2O5-2 MolecularWeight: 266.24996

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H16N2O5/c1-3-6(2)10(12(18)19)14-11(17)7-4-8(15)13-9(16)5-7/h4-6,10H,3H2,1-2H3,(H,14,17)(H,18,19)(H2,13,15,16)/p-2/t6-,10-/m0/s1