4-butyl-1-propan-2-yl-3,5,8-trioxabicyclo[2.2.2]octane

Systemtic Name: 4-butyl-1-propan-2-yl-3,5,8-trioxabicyclo[2.2.2]octane Openeye Name: 4-butyl-1-isopropyl-3,5,8-trioxabicyclo[2.2.2]octane CAS Name: 4-butyl-1-propan-2-yl-3,5,8-trioxabicyclo[2.2.2]octane IUPAC Name: 4-butyl-1-propan-2-yl-3,5,8-trioxabicyclo[2.2.2]octane Traditional Name: 4-butyl-1-isopropyl-3,5,8-trioxabicyclo[2.2.2]octane Formula: C12H22O3 MolecularWeight: 214.30128

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC12OCC(CO1)(CO2)C(C)C

Isomeric SMILES

CCCCC12OCC(CO1)(CO2)C(C)C

InChI

InChI=1S/C12H22O3/c1-4-5-6-12-13-7-11(8-14-12,9-15-12)10(2)3/h10H,4-9H2,1-3H3