6-(1-adamantyl)-2,3-bis(oxidanylidene)hexanoic acid

Systemtic Name: 6-(1-adamantyl)-2,3-bis(oxidanylidene)hexanoic acid Openeye Name: 6-(1-adamantyl)-2,3-dioxo-hexanoic acid CAS Name: 6-(1-adamantyl)-2,3-dioxohexanoic acid IUPAC Name: 6-(1-adamantyl)-2,3-dioxohexanoic acid Traditional Name: 6-(1-adamantyl)-2,3-diketo-hexanoic acid Formula: C16H22O4 MolecularWeight: 278.34348

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)CCCC(=O)C(=O)C(=O)O

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)CCCC(=O)C(=O)C(=O)O

InChI

InChI=1S/C16H22O4/c17-13(14(18)15(19)20)2-1-3-16-7-10-4-11(8-16)6-12(5-10)9-16/h10-12H,1-9H2,(H,19,20)