N-[5-(2-chloranyl-5-methoxy-phenoxy)-2-methanoyl-6-(2-methoxyethoxy)pyrimidin-4-yl]-1,3-benzodioxole-5-sulfonamide

Systemtic Name: N-[5-(2-chloranyl-5-methoxy-phenoxy)-2-methanoyl-6-(2-methoxyethoxy)pyrimidin-4-yl]-1,3-benzodioxole-5-sulfonamide Openeye Name: N-[5-(2-chloro-5-methoxy-phenoxy)-2-formyl-6-(2-methoxyethoxy)pyrimidin-4-yl]-1,3-benzodioxole-5-sulfonamide CAS Name: N-[5-(2-chloro-5-methoxyphenoxy)-2-formyl-6-(2-methoxyethoxy)-4-pyrimidinyl]-1,3-benzodioxole-5-sulfonamide IUPAC Name: N-[5-(2-chloro-5-methoxyphenoxy)-2-formyl-6-(2-methoxyethoxy)pyrimidin-4-yl]-1,3-benzodioxole-5-sulfonamide Traditional Name: N-[5-(2-chloro-5-methoxy-phenoxy)-2-formyl-6-(2-methoxyethoxy)pyrimidin-4-yl]-1,3-benzodioxole-5-sulfonamide Formula: C22H20ClN3O9S MolecularWeight: 537.9269

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Descriptors Computed from Structure

Canonical SMILES:

COCCOC1=NC(=NC(=C1OC2=C(C=CC(=C2)OC)Cl)NS(=O)(=O)C3=CC4=C(C=C3)OCO4)C=O

Isomeric SMILES

COCCOC1=NC(=NC(=C1OC2=C(C=CC(=C2)OC)Cl)NS(=O)(=O)C3=CC4=C(C=C3)OCO4)C=O

InChI

InChI=1S/C22H20ClN3O9S/c1-30-7-8-32-22-20(35-17-9-13(31-2)3-5-15(17)23)21(24-19(11-27)25-22)26-36(28,29)14-4-6-16-18(10-14)34-12-33-16/h3-6,9-11H,7-8,12H2,1-2H3,(H,24,25,26)