2-[[4-(dimethoxymethyl)-6-methoxy-pyrimidin-2-yl]carbamoylsulfamoyl]benzoic acid

Systemtic Name: 2-[[4-(dimethoxymethyl)-6-methoxy-pyrimidin-2-yl]carbamoylsulfamoyl]benzoic acid Openeye Name: 2-[[4-(dimethoxymethyl)-6-methoxy-pyrimidin-2-yl]carbamoylsulfamoyl]benzoic acid CAS Name: 2-[[[[4-(dimethoxymethyl)-6-methoxy-2-pyrimidinyl]amino]-oxomethyl]sulfamoyl]benzoic acid IUPAC Name: 2-[[4-(dimethoxymethyl)-6-methoxypyrimidin-2-yl]carbamoylsulfamoyl]benzoic acid Traditional Name: 2-[[4-(dimethoxymethyl)-6-methoxy-pyrimidin-2-yl]carbamoylsulfamoyl]benzoic acid Formula: C16H18N4O8S MolecularWeight: 426.40112

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC(=NC(=C1)C(OC)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)O

Isomeric SMILES

COC1=NC(=NC(=C1)C(OC)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)O

InChI

InChI=1S/C16H18N4O8S/c1-26-12-8-10(14(27-2)28-3)17-15(18-12)19-16(23)20-29(24,25)11-7-5-4-6-9(11)13(21)22/h4-8,14H,1-3H3,(H,21,22)(H2,17,18,19,20,23)