3-chloranyl-N-[2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-2-pyridin-3-yl-ethyl]benzamide

Systemtic Name: 3-chloranyl-N-[2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-2-pyridin-3-yl-ethyl]benzamide Openeye Name: 3-chloro-N-[2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-2-(3-pyridyl)ethyl]benzamide CAS Name: 3-chloro-N-[2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-2-(3-pyridinyl)ethyl]benzamide IUPAC Name: 3-chloro-N-[2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-2-pyridin-3-ylethyl]benzamide Traditional Name: 3-chloro-N-[2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-2-(3-pyridyl)ethyl]benzamide Formula: C22H19ClN2O5S MolecularWeight: 458.91466

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H19ClN2O5S/c23-17-5-1-3-15(11-17)22(26)25-14-21(16-4-2-8-24-13-16)31(27,28)18-6-7-19-20(12-18)30-10-9-29-19/h1-8,11-13,21H,9-10,14H2,(H,25,26)