3-[2-(phenylcarbonyl)phenoxy]-2-phosphono-benzenesulfonic acid

Systemtic Name: 3-[2-(phenylcarbonyl)phenoxy]-2-phosphono-benzenesulfonic acid Openeye Name: 3-(2-benzoylphenoxy)-2-phosphono-benzenesulfonic acid CAS Name: 3-(2-benzoylphenoxy)-2-phosphonobenzenesulfonic acid IUPAC Name: 3-(2-benzoylphenoxy)-2-phosphonobenzenesulfonic acid Traditional Name: 3-(2-benzoylphenoxy)-2-phosphono-besylic acid Formula: C19H15O8PS MolecularWeight: 434.356361

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C2=CC=CC=C2OC3=C(C(=CC=C3)S(=O)(=O)O)P(=O)(O)O

Isomeric SMILES

C1=CC=C(C=C1)C(=O)C2=CC=CC=C2OC3=C(C(=CC=C3)S(=O)(=O)O)P(=O)(O)O

InChI

InChI=1S/C19H15O8PS/c20-18(13-7-2-1-3-8-13)14-9-4-5-10-15(14)27-16-11-6-12-17(29(24,25)26)19(16)28(21,22)23/h1-12H,(H2,21,22,23)(H,24,25,26)