3-butan-2-yloxy-7-oxabicyclo[2.2.1]hepta-1,3,5-triene; propyl ethanesulfonate

Systemtic Name: 3-butan-2-yloxy-7-oxabicyclo[2.2.1]hepta-1,3,5-triene; propyl ethanesulfonate Openeye Name: propyl ethanesulfonate; 3-sec-butoxy-7-oxabicyclo[2.2.1]hepta-1,3,5-triene CAS Name: 3-butan-2-yloxy-7-oxabicyclo[2.2.1]hepta-1,3,5-triene; ethanesulfonic acid propyl ester IUPAC Name: 3-butan-2-yloxy-7-oxabicyclo[2.2.1]hepta-1,3,5-triene; propyl ethanesulfonate Traditional Name: ethanesulfonic acid propyl ester; 3-sec-butoxy-7-oxabicyclo[2.2.1]hepta-1,3,5-triene Formula: C15H24O5S MolecularWeight: 316.41306

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOS(=O)(=O)CC.CCC(C)OC1=C2C=CC(=C1)O2

Isomeric SMILES

CCCOS(=O)(=O)CC.CCC(C)OC1=C2C=CC(=C1)O2

InChI

InChI=1S/C10H12O2.C5H12O3S/c1-3-7(2)11-10-6-8-4-5-9(10)12-8;1-3-5-8-9(6,7)4-2/h4-7H,3H2,1-2H3;3-5H2,1-2H3