[2-azanyl-5,6-bis(fluoranyl)-1,3-benzothiazol-4-yl]oxymethylphosphonic acid

Systemtic Name: [2-azanyl-5,6-bis(fluoranyl)-1,3-benzothiazol-4-yl]oxymethylphosphonic acid Openeye Name: (2-amino-5,6-difluoro-1,3-benzothiazol-4-yl)oxymethylphosphonic acid CAS Name: (2-amino-5,6-difluoro-1,3-benzothiazol-4-yl)oxymethylphosphonic acid IUPAC Name: (2-amino-5,6-difluoro-1,3-benzothiazol-4-yl)oxymethylphosphonic acid Traditional Name: (2-amino-5,6-difluoro-1,3-benzothiazol-4-yl)oxymethylphosphonic acid Formula: C8H7F2N2O4PS MolecularWeight: 296.187747

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=C(C2=C1SC(=N2)N)OCP(=O)(O)O)F)F

Isomeric SMILES

C1=C(C(=C(C2=C1SC(=N2)N)OCP(=O)(O)O)F)F

InChI

InChI=1S/C8H7F2N2O4PS/c9-3-1-4-6(12-8(11)18-4)7(5(3)10)16-2-17(13,14)15/h1H,2H2,(H2,11,12)(H2,13,14,15)