[methyl-(4-nitrophenyl)sulfonyl-amino]methyl 4-(trifluoromethyl)benzoate

Systemtic Name: [methyl-(4-nitrophenyl)sulfonyl-amino]methyl 4-(trifluoromethyl)benzoate Openeye Name: [methyl-(4-nitrophenyl)sulfonyl-amino]methyl 4-(trifluoromethyl)benzoate CAS Name: 4-(trifluoromethyl)benzoic acid [methyl-(4-nitrophenyl)sulfonylamino]methyl ester IUPAC Name: [methyl-(4-nitrophenyl)sulfonylamino]methyl 4-(trifluoromethyl)benzoate Traditional Name: 4-(trifluoromethyl)benzoic acid [methyl(nosyl)amino]methyl ester Formula: C16H13F3N2O6S MolecularWeight: 418.34443

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Descriptors Computed from Structure

Canonical SMILES:

CN(COC(=O)C1=CC=C(C=C1)C(F)(F)F)S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CN(COC(=O)C1=CC=C(C=C1)C(F)(F)F)S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H13F3N2O6S/c1-20(28(25,26)14-8-6-13(7-9-14)21(23)24)10-27-15(22)11-2-4-12(5-3-11)16(17,18)19/h2-9H,10H2,1H3