methyl 2-[[2-(hydroxymethyl)-4-methoxy-2H-1,3,5-triazin-1-yl]carbamoylsulfamoyl]benzoate

Systemtic Name: methyl 2-[[2-(hydroxymethyl)-4-methoxy-2H-1,3,5-triazin-1-yl]carbamoylsulfamoyl]benzoate Openeye Name: methyl 2-[[2-(hydroxymethyl)-4-methoxy-2H-1,3,5-triazin-1-yl]carbamoylsulfamoyl]benzoate CAS Name: 2-[[[[2-(hydroxymethyl)-4-methoxy-2H-1,3,5-triazin-1-yl]amino]-oxomethyl]sulfamoyl]benzoic acid methyl ester IUPAC Name: methyl 2-[[2-(hydroxymethyl)-4-methoxy-2H-1,3,5-triazin-1-yl]carbamoylsulfamoyl]benzoate Traditional Name: 2-[(4-methoxy-2-methylol-2H-s-triazin-1-yl)carbamoylsulfamoyl]benzoic acid methyl ester Formula: C14H17N5O7S MolecularWeight: 399.37908

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC(N(C=N1)NC(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC)CO

Isomeric SMILES

COC1=NC(N(C=N1)NC(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC)CO

InChI

InChI=1S/C14H17N5O7S/c1-25-12(21)9-5-3-4-6-10(9)27(23,24)18-13(22)17-19-8-15-14(26-2)16-11(19)7-20/h3-6,8,11,20H,7H2,1-2H3,(H2,17,18,22)