(2-azanyl-6-bromanyl-7-methoxy-1,3-benzothiazol-4-yl)oxymethylphosphonic acid

Systemtic Name: (2-azanyl-6-bromanyl-7-methoxy-1,3-benzothiazol-4-yl)oxymethylphosphonic acid Openeye Name: (2-amino-6-bromo-7-methoxy-1,3-benzothiazol-4-yl)oxymethylphosphonic acid CAS Name: (2-amino-6-bromo-7-methoxy-1,3-benzothiazol-4-yl)oxymethylphosphonic acid IUPAC Name: (2-amino-6-bromo-7-methoxy-1,3-benzothiazol-4-yl)oxymethylphosphonic acid Traditional Name: (2-amino-6-bromo-7-methoxy-1,3-benzothiazol-4-yl)oxymethylphosphonic acid Formula: C9H10BrN2O5PS MolecularWeight: 369.128861

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C2=C1SC(=N2)N)OCP(=O)(O)O)Br

Isomeric SMILES

COC1=C(C=C(C2=C1SC(=N2)N)OCP(=O)(O)O)Br

InChI

InChI=1S/C9H10BrN2O5PS/c1-16-7-4(10)2-5(17-3-18(13,14)15)6-8(7)19-9(11)12-6/h2H,3H2,1H3,(H2,11,12)(H2,13,14,15)