4-(oxepan-4-yl)-2,3-bis(oxidanylidene)pentanoic acid

Systemtic Name: 4-(oxepan-4-yl)-2,3-bis(oxidanylidene)pentanoic acid Openeye Name: 4-(oxepan-4-yl)-2,3-dioxo-pentanoic acid CAS Name: 4-(4-oxepanyl)-2,3-dioxopentanoic acid IUPAC Name: 4-(oxepan-4-yl)-2,3-dioxopentanoic acid Traditional Name: 2,3-diketo-4-(oxepan-4-yl)valeric acid Formula: C11H16O5 MolecularWeight: 228.24174

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1CCCOCC1)C(=O)C(=O)C(=O)O

Isomeric SMILES

CC(C1CCCOCC1)C(=O)C(=O)C(=O)O

InChI

InChI=1S/C11H16O5/c1-7(9(12)10(13)11(14)15)8-3-2-5-16-6-4-8/h7-8H,2-6H2,1H3,(H,14,15)