1-adamantyl 2-hexylperoxy-2-oxidanylidene-ethanoate

Systemtic Name: 1-adamantyl 2-hexylperoxy-2-oxidanylidene-ethanoate Openeye Name: 1-adamantyl 2-hexylperoxy-2-oxo-acetate CAS Name: 2-hexyldioxy-2-oxoacetic acid 1-adamantyl ester IUPAC Name: 1-adamantyl 2-hexylperoxy-2-oxoacetate Traditional Name: 2-hexylperoxy-2-keto-acetic acid 1-adamantyl ester Formula: C18H28O5 MolecularWeight: 324.41192

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOOC(=O)C(=O)OC12CC3CC(C1)CC(C3)C2

Isomeric SMILES

CCCCCCOOC(=O)C(=O)OC12CC3CC(C1)CC(C3)C2

InChI

InChI=1S/C18H28O5/c1-2-3-4-5-6-21-23-17(20)16(19)22-18-10-13-7-14(11-18)9-15(8-13)12-18/h13-15H,2-12H2,1H3