ethyl 9-(trifluoromethylsulfonyloxy)-2,3-dihydro-1-benzoxepine-4-carboxylate

Systemtic Name: ethyl 9-(trifluoromethylsulfonyloxy)-2,3-dihydro-1-benzoxepine-4-carboxylate Openeye Name: ethyl 9-(trifluoromethylsulfonyloxy)-2,3-dihydro-1-benzoxepine-4-carboxylate CAS Name: 9-(trifluoromethylsulfonyloxy)-2,3-dihydro-1-benzoxepin-4-carboxylic acid ethyl ester IUPAC Name: ethyl 9-(trifluoromethylsulfonyloxy)-2,3-dihydro-1-benzoxepine-4-carboxylate Traditional Name: 9-triflyloxy-2,3-dihydro-1-benzoxepin-4-carboxylic acid ethyl ester Formula: C14H13F3O6S MolecularWeight: 366.30963

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(C(=CC=C2)OS(=O)(=O)C(F)(F)F)OCC1

Isomeric SMILES

CCOC(=O)C1=CC2=C(C(=CC=C2)OS(=O)(=O)C(F)(F)F)OCC1

InChI

InChI=1S/C14H13F3O6S/c1-2-21-13(18)10-6-7-22-12-9(8-10)4-3-5-11(12)23-24(19,20)14(15,16)17/h3-5,8H,2,6-7H2,1H3