N-[2-(1,3-benzodioxol-5-ylsulfonyl)-2-pyridin-3-yl-ethyl]-2-(4-chloranylphenoxy)ethanamide

Systemtic Name: N-[2-(1,3-benzodioxol-5-ylsulfonyl)-2-pyridin-3-yl-ethyl]-2-(4-chloranylphenoxy)ethanamide Openeye Name: N-[2-(1,3-benzodioxol-5-ylsulfonyl)-2-(3-pyridyl)ethyl]-2-(4-chlorophenoxy)acetamide CAS Name: N-[2-(1,3-benzodioxol-5-ylsulfonyl)-2-(3-pyridinyl)ethyl]-2-(4-chlorophenoxy)acetamide IUPAC Name: N-[2-(1,3-benzodioxol-5-ylsulfonyl)-2-pyridin-3-ylethyl]-2-(4-chlorophenoxy)acetamide Traditional Name: N-[2-(1,3-benzodioxol-5-ylsulfonyl)-2-(3-pyridyl)ethyl]-2-(4-chlorophenoxy)acetamide Formula: C22H19ClN2O6S MolecularWeight: 474.91406

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)S(=O)(=O)C(CNC(=O)COC3=CC=C(C=C3)Cl)C4=CN=CC=C4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)S(=O)(=O)C(CNC(=O)COC3=CC=C(C=C3)Cl)C4=CN=CC=C4

InChI

InChI=1S/C22H19ClN2O6S/c23-16-3-5-17(6-4-16)29-13-22(26)25-12-21(15-2-1-9-24-11-15)32(27,28)18-7-8-19-20(10-18)31-14-30-19/h1-11,21H,12-14H2,(H,25,26)