N-[2-(4-chlorophenyl)sulfonyl-2-pyridin-3-yl-ethyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide

Systemtic Name: N-[2-(4-chlorophenyl)sulfonyl-2-pyridin-3-yl-ethyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide Openeye Name: N-[2-(4-chlorophenyl)sulfonyl-2-(3-pyridyl)ethyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide CAS Name: N-[2-(4-chlorophenyl)sulfonyl-2-(3-pyridinyl)ethyl]-2,3-dihydro-1,4-benzodioxin-6-sulfonamide IUPAC Name: N-[2-(4-chlorophenyl)sulfonyl-2-pyridin-3-ylethyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide Traditional Name: N-[2-(4-chlorophenyl)sulfonyl-2-(3-pyridyl)ethyl]-2,3-dihydro-1,4-benzodioxin-6-sulfonamide Formula: C21H19ClN2O6S2 MolecularWeight: 494.96836

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)S(=O)(=O)NCC(C3=CN=CC=C3)S(=O)(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)S(=O)(=O)NCC(C3=CN=CC=C3)S(=O)(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H19ClN2O6S2/c22-16-3-5-17(6-4-16)31(25,26)21(15-2-1-9-23-13-15)14-24-32(27,28)18-7-8-19-20(12-18)30-11-10-29-19/h1-9,12-13,21,24H,10-11,14H2