(2-bromanyl-4-methanoyl-6-methoxy-phenyl) 2,1,3-benzothiadiazole-4-sulfonate

Systemtic Name: (2-bromanyl-4-methanoyl-6-methoxy-phenyl) 2,1,3-benzothiadiazole-4-sulfonate Openeye Name: (2-bromo-4-formyl-6-methoxy-phenyl) 2,1,3-benzothiadiazole-4-sulfonate CAS Name: 2,1,3-benzothiadiazole-4-sulfonic acid (2-bromo-4-formyl-6-methoxyphenyl) ester IUPAC Name: (2-bromo-4-formyl-6-methoxyphenyl) 2,1,3-benzothiadiazole-4-sulfonate Traditional Name: piazthiole-4-sulfonic acid (2-bromo-4-formyl-6-methoxy-phenyl) ester Formula: C14H9BrN2O5S2 MolecularWeight: 429.26566

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=O)Br)OS(=O)(=O)C2=CC=CC3=NSN=C32

Isomeric SMILES

COC1=C(C(=CC(=C1)C=O)Br)OS(=O)(=O)C2=CC=CC3=NSN=C32

InChI

InChI=1S/C14H9BrN2O5S2/c1-21-11-6-8(7-18)5-9(15)14(11)22-24(19,20)12-4-2-3-10-13(12)17-23-16-10/h2-7H,1H3