3,3-dimethyl-2-[(6-oxidanylidenepyran-3-yl)carbonylamino]butanoic acid

Systemtic Name: 3,3-dimethyl-2-[(6-oxidanylidenepyran-3-yl)carbonylamino]butanoic acid Openeye Name: 3,3-dimethyl-2-[(6-oxopyran-3-carbonyl)amino]butanoic acid CAS Name: 3,3-dimethyl-2-[[oxo-(6-oxo-3-pyranyl)methyl]amino]butanoic acid IUPAC Name: 3,3-dimethyl-2-[(6-oxopyran-3-carbonyl)amino]butanoic acid Traditional Name: 2-[(6-ketopyran-3-carbonyl)amino]-3,3-dimethyl-butyric acid Formula: C12H15NO5 MolecularWeight: 253.2512

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(C(=O)O)NC(=O)C1=COC(=O)C=C1

Isomeric SMILES

CC(C)(C)C(C(=O)O)NC(=O)C1=COC(=O)C=C1

InChI

InChI=1S/C12H15NO5/c1-12(2,3)9(11(16)17)13-10(15)7-4-5-8(14)18-6-7/h4-6,9H,1-3H3,(H,13,15)(H,16,17)