propan-2-yl 3-[bis(fluoranyl)methoxy]-2-isocyanatosulfonyl-benzoate

Systemtic Name: propan-2-yl 3-[bis(fluoranyl)methoxy]-2-isocyanatosulfonyl-benzoate Openeye Name: isopropyl 3-(difluoromethoxy)-2-isocyanatosulfonyl-benzoate CAS Name: 3-(difluoromethoxy)-2-isocyanatosulfonylbenzoic acid propan-2-yl ester IUPAC Name: propan-2-yl 3-(difluoromethoxy)-2-isocyanatosulfonylbenzoate Traditional Name: 3-(difluoromethoxy)-2-isocyanatosulfonyl-benzoic acid isopropyl ester Formula: C12H11F2NO6S MolecularWeight: 335.280646

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=C(C(=CC=C1)OC(F)F)S(=O)(=O)N=C=O

Isomeric SMILES

CC(C)OC(=O)C1=C(C(=CC=C1)OC(F)F)S(=O)(=O)N=C=O

InChI

InChI=1S/C12H11F2NO6S/c1-7(2)20-11(17)8-4-3-5-9(21-12(13)14)10(8)22(18,19)15-6-16/h3-5,7,12H,1-2H3