N-chloranyl-1,1,1-tris(fluoranyl)methanesulfonamide; methyl benzoate

Systemtic Name: N-chloranyl-1,1,1-tris(fluoranyl)methanesulfonamide; methyl benzoate Openeye Name: N-chloro-1,1,1-trifluoro-methanesulfonamide; methyl benzoate CAS Name: benzoic acid methyl ester; N-chloro-1,1,1-trifluoromethanesulfonamide IUPAC Name: N-chloro-1,1,1-trifluoromethanesulfonamide; methyl benzoate Traditional Name: benzoic acid methyl ester; N-chloro-1,1,1-trifluoro-methanesulfonamide Formula: C9H9ClF3NO4S MolecularWeight: 319.68527

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1.C(F)(F)(F)S(=O)(=O)NCl

Isomeric SMILES

COC(=O)C1=CC=CC=C1.C(F)(F)(F)S(=O)(=O)NCl

InChI

InChI=1S/C8H8O2.CHClF3NO2S/c1-10-8(9)7-5-3-2-4-6-7;2-6-9(7,8)1(3,4)5/h2-6H,1H3;6H