2-[(4,6-dimethoxy-1,3,5-triazin-2-yl)carbamoylsulfamoylmethyl]benzoic acid

Systemtic Name: 2-[(4,6-dimethoxy-1,3,5-triazin-2-yl)carbamoylsulfamoylmethyl]benzoic acid Openeye Name: 2-[(4,6-dimethoxy-1,3,5-triazin-2-yl)carbamoylsulfamoylmethyl]benzoic acid CAS Name: 2-[[[(4,6-dimethoxy-1,3,5-triazin-2-yl)amino]-oxomethyl]sulfamoylmethyl]benzoic acid IUPAC Name: 2-[(4,6-dimethoxy-1,3,5-triazin-2-yl)carbamoylsulfamoylmethyl]benzoic acid Traditional Name: 2-[(4,6-dimethoxy-s-triazin-2-yl)carbamoylsulfamoylmethyl]benzoic acid Formula: C14H15N5O7S MolecularWeight: 397.3632

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC(=NC(=N1)NC(=O)NS(=O)(=O)CC2=CC=CC=C2C(=O)O)OC

Isomeric SMILES

COC1=NC(=NC(=N1)NC(=O)NS(=O)(=O)CC2=CC=CC=C2C(=O)O)OC

InChI

InChI=1S/C14H15N5O7S/c1-25-13-16-11(17-14(18-13)26-2)15-12(22)19-27(23,24)7-8-5-3-4-6-9(8)10(20)21/h3-6H,7H2,1-2H3,(H,20,21)(H2,15,16,17,18,19,22)