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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H11F2NO6S/c1-2-6-20-11(17)8-4-3-5-9(21-12(13)14)10(8)22(18,19)15-7-16/h3-5,12H,2,6H2,1H3