ethyl 2-[(4-chlorophenyl)sulfonylmethyl]-4-(trifluoromethylsulfonyloxy)-1,3-thiazole-5-carboxylate

Systemtic Name: ethyl 2-[(4-chlorophenyl)sulfonylmethyl]-4-(trifluoromethylsulfonyloxy)-1,3-thiazole-5-carboxylate Openeye Name: ethyl 2-[(4-chlorophenyl)sulfonylmethyl]-4-(trifluoromethylsulfonyloxy)thiazole-5-carboxylate CAS Name: 2-[(4-chlorophenyl)sulfonylmethyl]-4-(trifluoromethylsulfonyloxy)-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(4-chlorophenyl)sulfonylmethyl]-4-(trifluoromethylsulfonyloxy)-1,3-thiazole-5-carboxylate Traditional Name: 2-[(4-chlorophenyl)sulfonylmethyl]-4-triflyloxy-thiazole-5-carboxylic acid ethyl ester Formula: C14H11ClF3NO7S3 MolecularWeight: 493.88285

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(S1)CS(=O)(=O)C2=CC=C(C=C2)Cl)OS(=O)(=O)C(F)(F)F

Isomeric SMILES

CCOC(=O)C1=C(N=C(S1)CS(=O)(=O)C2=CC=C(C=C2)Cl)OS(=O)(=O)C(F)(F)F

InChI

InChI=1S/C14H11ClF3NO7S3/c1-2-25-13(20)11-12(26-29(23,24)14(16,17)18)19-10(27-11)7-28(21,22)9-5-3-8(15)4-6-9/h3-6H,2,7H2,1H3