5-(1-adamantyl)-2,3-bis(oxidanylidene)hexanoic acid

Systemtic Name: 5-(1-adamantyl)-2,3-bis(oxidanylidene)hexanoic acid Openeye Name: 5-(1-adamantyl)-2,3-dioxo-hexanoic acid CAS Name: 5-(1-adamantyl)-2,3-dioxohexanoic acid IUPAC Name: 5-(1-adamantyl)-2,3-dioxohexanoic acid Traditional Name: 5-(1-adamantyl)-2,3-diketo-hexanoic acid Formula: C16H22O4 MolecularWeight: 278.34348

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)C(=O)C(=O)O)C12CC3CC(C1)CC(C3)C2

Isomeric SMILES

CC(CC(=O)C(=O)C(=O)O)C12CC3CC(C1)CC(C3)C2

InChI

InChI=1S/C16H22O4/c1-9(2-13(17)14(18)15(19)20)16-6-10-3-11(7-16)5-12(4-10)8-16/h9-12H,2-8H2,1H3,(H,19,20)