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

Systemtic Name: propan-2-yl 2-isocyanatosulfonyl-3-(trifluoromethyl)benzoate Openeye Name: isopropyl 2-isocyanatosulfonyl-3-(trifluoromethyl)benzoate CAS Name: 2-isocyanatosulfonyl-3-(trifluoromethyl)benzoic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-isocyanatosulfonyl-3-(trifluoromethyl)benzoate Traditional Name: 2-isocyanatosulfonyl-3-(trifluoromethyl)benzoic acid isopropyl ester Formula: C12H10F3NO5S MolecularWeight: 337.27171

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H10F3NO5S/c1-7(2)21-11(18)8-4-3-5-9(12(13,14)15)10(8)22(19,20)16-6-17/h3-5,7H,1-2H3