2-(2,1,3-benzoxadiazol-5-ylcarbonylamino)ethanesulfinic acid

Systemtic Name: 2-(2,1,3-benzoxadiazol-5-ylcarbonylamino)ethanesulfinic acid Openeye Name: 2-(2,1,3-benzoxadiazole-5-carbonylamino)ethanesulfinic acid CAS Name: 2-[[2,1,3-benzoxadiazol-5-yl(oxo)methyl]amino]ethanesulfinic acid IUPAC Name: 2-(2,1,3-benzoxadiazole-5-carbonylamino)ethanesulfinic acid Traditional Name: 2-(benzofurazan-5-carbonylamino)ethanesulfinic acid Formula: C9H9N3O4S MolecularWeight: 255.25046

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=NON=C2C=C1C(=O)NCCS(=O)O

Isomeric SMILES

C1=CC2=NON=C2C=C1C(=O)NCCS(=O)O

InChI

InChI=1S/C9H9N3O4S/c13-9(10-3-4-17(14)15)6-1-2-7-8(5-6)12-16-11-7/h1-2,5H,3-4H2,(H,10,13)(H,14,15)