(2S)-4-methyl-2-[(6-oxidanylidenepyran-3-yl)carbonylamino]pentanoate

Systemtic Name: (2S)-4-methyl-2-[(6-oxidanylidenepyran-3-yl)carbonylamino]pentanoate Openeye Name: (2S)-4-methyl-2-[(6-oxopyran-3-carbonyl)amino]pentanoate CAS Name: (2S)-4-methyl-2-[[oxo-(6-oxo-3-pyranyl)methyl]amino]pentanoate IUPAC Name: (2S)-4-methyl-2-[(6-oxopyran-3-carbonyl)amino]pentanoate Traditional Name: (2S)-2-[(6-ketopyran-3-carbonyl)amino]-4-methyl-valerate Formula: C12H14NO5- MolecularWeight: 252.24326

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H15NO5/c1-7(2)5-9(12(16)17)13-11(15)8-3-4-10(14)18-6-8/h3-4,6-7,9H,5H2,1-2H3,(H,13,15)(H,16,17)/p-1/t9-/m0/s1