ethyl 2-isocyanatosulfonyl-3-(trifluoromethyloxy)benzoate

Systemtic Name: ethyl 2-isocyanatosulfonyl-3-(trifluoromethyloxy)benzoate Openeye Name: ethyl 2-isocyanatosulfonyl-3-(trifluoromethoxy)benzoate CAS Name: 2-isocyanatosulfonyl-3-(trifluoromethoxy)benzoic acid ethyl ester IUPAC Name: ethyl 2-isocyanatosulfonyl-3-(trifluoromethoxy)benzoate Traditional Name: 2-isocyanatosulfonyl-3-(trifluoromethoxy)benzoic acid ethyl ester Formula: C11H8F3NO6S MolecularWeight: 339.24453

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H8F3NO6S/c1-2-20-10(17)7-4-3-5-8(21-11(12,13)14)9(7)22(18,19)15-6-16/h3-5H,2H2,1H3