methyl 3-[(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)sulfamoyl]benzoate

Systemtic Name: methyl 3-[(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)sulfamoyl]benzoate Openeye Name: methyl 3-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)sulfamoyl]benzoate CAS Name: 3-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)sulfamoyl]benzoic acid methyl ester IUPAC Name: methyl 3-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)sulfamoyl]benzoate Traditional Name: 3-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)sulfamoyl]benzoic acid methyl ester Formula: C16H14BrNO6S MolecularWeight: 428.25446

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)S(=O)(=O)NC2=CC3=C(C=C2Br)OCCO3

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)S(=O)(=O)NC2=CC3=C(C=C2Br)OCCO3

InChI

InChI=1S/C16H14BrNO6S/c1-22-16(19)10-3-2-4-11(7-10)25(20,21)18-13-9-15-14(8-12(13)17)23-5-6-24-15/h2-4,7-9,18H,5-6H2,1H3