oxetan-2-yl 2-isocyanatosulfonyl-3-(trifluoromethyloxy)benzoate

Systemtic Name: oxetan-2-yl 2-isocyanatosulfonyl-3-(trifluoromethyloxy)benzoate Openeye Name: oxetan-2-yl 2-isocyanatosulfonyl-3-(trifluoromethoxy)benzoate CAS Name: 2-isocyanatosulfonyl-3-(trifluoromethoxy)benzoic acid 2-oxetanyl ester IUPAC Name: oxetan-2-yl 2-isocyanatosulfonyl-3-(trifluoromethoxy)benzoate Traditional Name: 2-isocyanatosulfonyl-3-(trifluoromethoxy)benzoic acid oxetan-2-yl ester Formula: C12H8F3NO7S MolecularWeight: 367.25463

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COC1OC(=O)C2=C(C(=CC=C2)OC(F)(F)F)S(=O)(=O)N=C=O

Isomeric SMILES

C1COC1OC(=O)C2=C(C(=CC=C2)OC(F)(F)F)S(=O)(=O)N=C=O

InChI

InChI=1S/C12H8F3NO7S/c13-12(14,15)23-8-3-1-2-7(10(8)24(19,20)16-6-17)11(18)22-9-4-5-21-9/h1-3,9H,4-5H2