sodium 2-[(4,6-dimethoxypyrimidin-2-yl)carbamoylsulfamoyloxy]benzoate

Systemtic Name: sodium 2-[(4,6-dimethoxypyrimidin-2-yl)carbamoylsulfamoyloxy]benzoate Openeye Name: sodium 2-[(4,6-dimethoxypyrimidin-2-yl)carbamoylsulfamoyloxy]benzoate CAS Name: sodium 2-[[[(4,6-dimethoxy-2-pyrimidinyl)amino]-oxomethyl]sulfamoyloxy]benzoate IUPAC Name: sodium 2-[(4,6-dimethoxypyrimidin-2-yl)carbamoylsulfamoyloxy]benzoate Traditional Name: sodium 2-[(4,6-dimethoxypyrimidin-2-yl)carbamoylsulfamoyloxy]benzoate Formula: C14H13N4NaO8S MolecularWeight: 420.32979

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=NC(=N1)NC(=O)NS(=O)(=O)OC2=CC=CC=C2C(=O)[O-])OC.[Na+]

Isomeric SMILES

COC1=CC(=NC(=N1)NC(=O)NS(=O)(=O)OC2=CC=CC=C2C(=O)[O-])OC.[Na+]

InChI

InChI=1S/C14H14N4O8S.Na/c1-24-10-7-11(25-2)16-13(15-10)17-14(21)18-27(22,23)26-9-6-4-3-5-8(9)12(19)20;/h3-7H,1-2H3,(H,19,20)(H2,15,16,17,18,21);/q;+1/p-1