4-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(2,6-dimethoxypyridin-3-yl)-N-methylsulfonyl-4-oxidanylidene-butanamide

Systemtic Name: 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(2,6-dimethoxypyridin-3-yl)-N-methylsulfonyl-4-oxidanylidene-butanamide Openeye Name: 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(2,6-dimethoxy-3-pyridyl)-N-methylsulfonyl-4-oxo-butanamide CAS Name: 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(2,6-dimethoxy-3-pyridinyl)-N-methylsulfonyl-4-oxobutanamide IUPAC Name: 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(2,6-dimethoxypyridin-3-yl)-N-methylsulfonyl-4-oxobutanamide Traditional Name: 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(2,6-dimethoxy-3-pyridyl)-4-keto-N-mesyl-butyramide Formula: C20H22N2O8S MolecularWeight: 450.46228

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC(=C(C=C1)N(C(=O)CCC(=O)C2=CC3=C(C=C2)OCCO3)S(=O)(=O)C)OC

Isomeric SMILES

COC1=NC(=C(C=C1)N(C(=O)CCC(=O)C2=CC3=C(C=C2)OCCO3)S(=O)(=O)C)OC

InChI

InChI=1S/C20H22N2O8S/c1-27-18-8-5-14(20(21-18)28-2)22(31(3,25)26)19(24)9-6-15(23)13-4-7-16-17(12-13)30-11-10-29-16/h4-5,7-8,12H,6,9-11H2,1-3H3