(6-chloranylpyridin-3-yl)methyl 4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)butanoate

Systemtic Name: (6-chloranylpyridin-3-yl)methyl 4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)butanoate Openeye Name: (6-chloro-3-pyridyl)methyl 4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)butanoate CAS Name: 4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)butanoic acid (6-chloro-3-pyridinyl)methyl ester IUPAC Name: (6-chloropyridin-3-yl)methyl 4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)butanoate Traditional Name: 4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)butyric acid (6-chloro-3-pyridyl)methyl ester Formula: C18H19ClN2O6S MolecularWeight: 426.87126

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)S(=O)(=O)NCCCC(=O)OCC3=CN=C(C=C3)Cl

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)S(=O)(=O)NCCCC(=O)OCC3=CN=C(C=C3)Cl

InChI

InChI=1S/C18H19ClN2O6S/c19-17-6-3-13(11-20-17)12-27-18(22)2-1-7-21-28(23,24)14-4-5-15-16(10-14)26-9-8-25-15/h3-6,10-11,21H,1-2,7-9,12H2