(5-propan-2-ylazulen-1-yl) tris(fluoranyl)methanesulfonate

Systemtic Name: (5-propan-2-ylazulen-1-yl) tris(fluoranyl)methanesulfonate Openeye Name: (5-isopropylazulen-1-yl) trifluoromethanesulfonate CAS Name: trifluoromethanesulfonic acid (5-propan-2-yl-1-azulenyl) ester IUPAC Name: (5-propan-2-ylazulen-1-yl) trifluoromethanesulfonate Traditional Name: trifluoromethanesulfonic acid (5-isopropylazulen-1-yl) ester Formula: C14H13F3O3S MolecularWeight: 318.31143

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC2=C(C=CC2=C1)OS(=O)(=O)C(F)(F)F

Isomeric SMILES

CC(C)C1=CC=CC2=C(C=CC2=C1)OS(=O)(=O)C(F)(F)F

InChI

InChI=1S/C14H13F3O3S/c1-9(2)10-4-3-5-12-11(8-10)6-7-13(12)20-21(18,19)14(15,16)17/h3-9H,1-2H3