(phenylmethyl) 7-fluoranyl-2,1,3-benzoxadiazole-4-sulfonate

Systemtic Name: (phenylmethyl) 7-fluoranyl-2,1,3-benzoxadiazole-4-sulfonate Openeye Name: benzyl 7-fluoro-2,1,3-benzoxadiazole-4-sulfonate CAS Name: 7-fluoro-2,1,3-benzoxadiazole-4-sulfonic acid (phenylmethyl) ester IUPAC Name: benzyl 7-fluoro-2,1,3-benzoxadiazole-4-sulfonate Traditional Name: 7-fluorobenzofurazan-4-sulfonic acid benzyl ester Formula: C13H9FN2O4S MolecularWeight: 308.284963

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COS(=O)(=O)C2=CC=C(C3=NON=C23)F

Isomeric SMILES

C1=CC=C(C=C1)COS(=O)(=O)C2=CC=C(C3=NON=C23)F

InChI

InChI=1S/C13H9FN2O4S/c14-10-6-7-11(13-12(10)15-20-16-13)21(17,18)19-8-9-4-2-1-3-5-9/h1-7H,8H2