methyl 4-chloranyl-2-[[4-methoxy-6-(trifluoromethyl)-1,3,5-triazin-2-yl]carbamoylsulfamoyl]benzoate

Systemtic Name: methyl 4-chloranyl-2-[[4-methoxy-6-(trifluoromethyl)-1,3,5-triazin-2-yl]carbamoylsulfamoyl]benzoate Openeye Name: methyl 4-chloro-2-[[4-methoxy-6-(trifluoromethyl)-1,3,5-triazin-2-yl]carbamoylsulfamoyl]benzoate CAS Name: 4-chloro-2-[[[[4-methoxy-6-(trifluoromethyl)-1,3,5-triazin-2-yl]amino]-oxomethyl]sulfamoyl]benzoic acid methyl ester IUPAC Name: methyl 4-chloro-2-[[4-methoxy-6-(trifluoromethyl)-1,3,5-triazin-2-yl]carbamoylsulfamoyl]benzoate Traditional Name: 4-chloro-2-[[4-methoxy-6-(trifluoromethyl)-s-triazin-2-yl]carbamoylsulfamoyl]benzoic acid methyl ester Formula: C14H11ClF3N5O6S MolecularWeight: 469.78025

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC(=NC(=N1)NC(=O)NS(=O)(=O)C2=C(C=CC(=C2)Cl)C(=O)OC)C(F)(F)F

Isomeric SMILES

COC1=NC(=NC(=N1)NC(=O)NS(=O)(=O)C2=C(C=CC(=C2)Cl)C(=O)OC)C(F)(F)F

InChI

InChI=1S/C14H11ClF3N5O6S/c1-28-9(24)7-4-3-6(15)5-8(7)30(26,27)23-12(25)21-11-19-10(14(16,17)18)20-13(22-11)29-2/h3-5H,1-2H3,(H2,19,20,21,22,23,25)