2-[[4-(1-methoxy-1-oxidanylidene-propan-2-yl)oxy-6-methyl-1,3,5-triazin-2-yl]carbamoylsulfamoyl]benzoic acid

Systemtic Name: 2-[[4-(1-methoxy-1-oxidanylidene-propan-2-yl)oxy-6-methyl-1,3,5-triazin-2-yl]carbamoylsulfamoyl]benzoic acid Openeye Name: 2-[[4-(2-methoxy-1-methyl-2-oxo-ethoxy)-6-methyl-1,3,5-triazin-2-yl]carbamoylsulfamoyl]benzoic acid CAS Name: 2-[[[[4-(1-methoxy-1-oxopropan-2-yl)oxy-6-methyl-1,3,5-triazin-2-yl]amino]-oxomethyl]sulfamoyl]benzoic acid IUPAC Name: 2-[[4-(1-methoxy-1-oxopropan-2-yl)oxy-6-methyl-1,3,5-triazin-2-yl]carbamoylsulfamoyl]benzoic acid Traditional Name: 2-[[4-(2-keto-2-methoxy-1-methyl-ethoxy)-6-methyl-s-triazin-2-yl]carbamoylsulfamoyl]benzoic acid Formula: C16H17N5O8S MolecularWeight: 439.39988

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC(=N1)OC(C)C(=O)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)O

Isomeric SMILES

CC1=NC(=NC(=N1)OC(C)C(=O)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)O

InChI

InChI=1S/C16H17N5O8S/c1-8(13(24)28-3)29-16-18-9(2)17-14(20-16)19-15(25)21-30(26,27)11-7-5-4-6-10(11)12(22)23/h4-8H,1-3H3,(H,22,23)(H2,17,18,19,20,21,25)