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

Systemtic Name: oxetan-2-yl 2-isocyanatosulfonyl-3-(trifluoromethyl)benzoate Openeye Name: oxetan-2-yl 2-isocyanatosulfonyl-3-(trifluoromethyl)benzoate CAS Name: 2-isocyanatosulfonyl-3-(trifluoromethyl)benzoic acid 2-oxetanyl ester IUPAC Name: oxetan-2-yl 2-isocyanatosulfonyl-3-(trifluoromethyl)benzoate Traditional Name: 2-isocyanatosulfonyl-3-(trifluoromethyl)benzoic acid oxetan-2-yl ester Formula: C12H8F3NO6S MolecularWeight: 351.25523

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H8F3NO6S/c13-12(14,15)8-3-1-2-7(10(8)23(19,20)16-6-17)11(18)22-9-4-5-21-9/h1-3,9H,4-5H2