tert-butyl 4-(trifluoromethylsulfonyloxy)spiro[chromene-2,3'-pyrrolidine]-1'-carboxylate

Systemtic Name: tert-butyl 4-(trifluoromethylsulfonyloxy)spiro[chromene-2,3'-pyrrolidine]-1'-carboxylate Openeye Name: tert-butyl 4-(trifluoromethylsulfonyloxy)spiro[chromene-2,3'-pyrrolidine]-1'-carboxylate CAS Name: 4-(trifluoromethylsulfonyloxy)-1'-spiro[1-benzopyran-2,3'-pyrrolidine]carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(trifluoromethylsulfonyloxy)spiro[chromene-2,3'-pyrrolidine]-1'-carboxylate Traditional Name: 4-triflyloxyspiro[chromene-2,3'-pyrrolidine]-1'-carboxylic acid tert-butyl ester Formula: C18H20F3NO6S MolecularWeight: 435.41471

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC2(C1)C=C(C3=CC=CC=C3O2)OS(=O)(=O)C(F)(F)F

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC2(C1)C=C(C3=CC=CC=C3O2)OS(=O)(=O)C(F)(F)F

InChI

InChI=1S/C18H20F3NO6S/c1-16(2,3)27-15(23)22-9-8-17(11-22)10-14(28-29(24,25)18(19,20)21)12-6-4-5-7-13(12)26-17/h4-7,10H,8-9,11H2,1-3H3