4-ethanoylperoxy-6-oxidanylidene-2-(2-oxidanylidenepropyl)-5-(phenylmethyl)pyran-3-carboxylic acid

Systemtic Name: 4-ethanoylperoxy-6-oxidanylidene-2-(2-oxidanylidenepropyl)-5-(phenylmethyl)pyran-3-carboxylic acid Openeye Name: 2-acetonyl-4-acetylperoxy-5-benzyl-6-oxo-pyran-3-carboxylic acid CAS Name: 4-acetyldioxy-6-oxo-2-(2-oxopropyl)-5-(phenylmethyl)-3-pyrancarboxylic acid IUPAC Name: 4-acetylperoxy-5-benzyl-6-oxo-2-(2-oxopropyl)pyran-3-carboxylic acid Traditional Name: 2-acetonyl-4-acetylperoxy-5-benzyl-6-keto-pyran-3-carboxylic acid Formula: C18H16O8 MolecularWeight: 360.31484

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC1=C(C(=C(C(=O)O1)CC2=CC=CC=C2)OOC(=O)C)C(=O)O

Isomeric SMILES

CC(=O)CC1=C(C(=C(C(=O)O1)CC2=CC=CC=C2)OOC(=O)C)C(=O)O

InChI

InChI=1S/C18H16O8/c1-10(19)8-14-15(17(21)22)16(26-25-11(2)20)13(18(23)24-14)9-12-6-4-3-5-7-12/h3-7H,8-9H2,1-2H3,(H,21,22)