6-(4-chloranyl-2,6-dimethoxy-pyrimidin-5-yl)hexane-1-sulfonic acid

Systemtic Name: 6-(4-chloranyl-2,6-dimethoxy-pyrimidin-5-yl)hexane-1-sulfonic acid Openeye Name: 6-(4-chloro-2,6-dimethoxy-pyrimidin-5-yl)hexane-1-sulfonic acid CAS Name: 6-(4-chloro-2,6-dimethoxy-5-pyrimidinyl)-1-hexanesulfonic acid IUPAC Name: 6-(4-chloro-2,6-dimethoxypyrimidin-5-yl)hexane-1-sulfonic acid Traditional Name: 6-(4-chloro-2,6-dimethoxy-pyrimidin-5-yl)hexane-1-sulfonic acid Formula: C12H19ClN2O5S MolecularWeight: 338.80766

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=NC(=N1)OC)Cl)CCCCCCS(=O)(=O)O

Isomeric SMILES

COC1=C(C(=NC(=N1)OC)Cl)CCCCCCS(=O)(=O)O

InChI

InChI=1S/C12H19ClN2O5S/c1-19-11-9(10(13)14-12(15-11)20-2)7-5-3-4-6-8-21(16,17)18/h3-8H2,1-2H3,(H,16,17,18)