ethyl 3-bromanyl-4-[2,3-dihydro-1,4-benzodioxin-3-ylmethyl(ethyl)sulfamoyl]benzoate

Systemtic Name: ethyl 3-bromanyl-4-[2,3-dihydro-1,4-benzodioxin-3-ylmethyl(ethyl)sulfamoyl]benzoate Openeye Name: ethyl 3-bromo-4-[2,3-dihydro-1,4-benzodioxin-3-ylmethyl(ethyl)sulfamoyl]benzoate CAS Name: 3-bromo-4-[2,3-dihydro-1,4-benzodioxin-3-ylmethyl(ethyl)sulfamoyl]benzoic acid ethyl ester IUPAC Name: ethyl 3-bromo-4-[2,3-dihydro-1,4-benzodioxin-3-ylmethyl(ethyl)sulfamoyl]benzoate Traditional Name: 3-bromo-4-[2,3-dihydro-1,4-benzodioxin-3-ylmethyl(ethyl)sulfamoyl]benzoic acid ethyl ester Formula: C20H22BrNO6S MolecularWeight: 484.36078

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1COC2=CC=CC=C2O1)S(=O)(=O)C3=C(C=C(C=C3)C(=O)OCC)Br

Isomeric SMILES

CCN(CC1COC2=CC=CC=C2O1)S(=O)(=O)C3=C(C=C(C=C3)C(=O)OCC)Br

InChI

InChI=1S/C20H22BrNO6S/c1-3-22(12-15-13-27-17-7-5-6-8-18(17)28-15)29(24,25)19-10-9-14(11-16(19)21)20(23)26-4-2/h5-11,15H,3-4,12-13H2,1-2H3