5-(2,2-dimethylpropanoyl)-4-oxidanylidene-3-phenylmethoxy-pyran-2-carboxylic acid

Systemtic Name: 5-(2,2-dimethylpropanoyl)-4-oxidanylidene-3-phenylmethoxy-pyran-2-carboxylic acid Openeye Name: 3-benzyloxy-5-(2,2-dimethylpropanoyl)-4-oxo-pyran-2-carboxylic acid CAS Name: 5-(2,2-dimethyl-1-oxopropyl)-4-oxo-3-phenylmethoxy-2-pyrancarboxylic acid IUPAC Name: 5-(2,2-dimethylpropanoyl)-4-oxo-3-phenylmethoxypyran-2-carboxylic acid Traditional Name: 3-benzoxy-4-keto-5-pivaloyl-pyran-2-carboxylic acid Formula: C18H18O6 MolecularWeight: 330.33192

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)C1=COC(=C(C1=O)OCC2=CC=CC=C2)C(=O)O

Isomeric SMILES

CC(C)(C)C(=O)C1=COC(=C(C1=O)OCC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C18H18O6/c1-18(2,3)16(20)12-10-24-15(17(21)22)14(13(12)19)23-9-11-7-5-4-6-8-11/h4-8,10H,9H2,1-3H3,(H,21,22)