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

Systemtic Name: 3-chloranyl-N-[2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-2-pyridin-3-yl-ethyl]propanamide Openeye Name: 3-chloro-N-[2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-2-(3-pyridyl)ethyl]propanamide CAS Name: 3-chloro-N-[2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-2-(3-pyridinyl)ethyl]propanamide IUPAC Name: 3-chloro-N-[2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-2-pyridin-3-ylethyl]propanamide Traditional Name: 3-chloro-N-[2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-2-(3-pyridyl)ethyl]propionamide Formula: C18H19ClN2O5S MolecularWeight: 410.87186

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19ClN2O5S/c19-6-5-18(22)21-12-17(13-2-1-7-20-11-13)27(23,24)14-3-4-15-16(10-14)26-9-8-25-15/h1-4,7,10-11,17H,5-6,8-9,12H2,(H,21,22)