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

Systemtic Name: (2S,3S)-3-methyl-2-[(2-oxidanidyl-4-oxidanylidene-1H-pyrimidin-6-yl)carbonylamino]pentanoate Openeye Name: (2S,3S)-3-methyl-2-[(2-oxido-4-oxo-1H-pyrimidine-6-carbonyl)amino]pentanoate CAS Name: (2S,3S)-3-methyl-2-[[(2-oxido-4-oxo-1H-pyrimidin-6-yl)-oxomethyl]amino]pentanoate IUPAC Name: (2S,3S)-3-methyl-2-[(2-oxido-4-oxo-1H-pyrimidine-6-carbonyl)amino]pentanoate Traditional Name: (2S,3S)-2-[(4-keto-2-oxido-1H-pyrimidine-6-carbonyl)amino]-3-methyl-valerate Formula: C11H13N3O5-2 MolecularWeight: 267.23802

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)[O-])NC(=O)C1=CC(=O)N=C(N1)[O-]

Isomeric SMILES

CC[C@H](C)[C@@H](C(=O)[O-])NC(=O)C1=CC(=O)N=C(N1)[O-]

InChI

InChI=1S/C11H15N3O5/c1-3-5(2)8(10(17)18)14-9(16)6-4-7(15)13-11(19)12-6/h4-5,8H,3H2,1-2H3,(H,14,16)(H,17,18)(H2,12,13,15,19)/p-2/t5-,8-/m0/s1