2-methoxy-5-[(4-methoxy-3-sulfo-phenyl)-phenyl-phosphanyl]benzenesulfonic acid

Systemtic Name: 2-methoxy-5-[(4-methoxy-3-sulfo-phenyl)-phenyl-phosphanyl]benzenesulfonic acid Openeye Name: 2-methoxy-5-[(4-methoxy-3-sulfo-phenyl)-phenyl-phosphanyl]benzenesulfonic acid CAS Name: 2-methoxy-5-[(4-methoxy-3-sulfophenyl)-phenylphosphino]benzenesulfonic acid IUPAC Name: 2-methoxy-5-[(4-methoxy-3-sulfophenyl)-phenylphosphanyl]benzenesulfonic acid Traditional Name: 2-methoxy-5-[(4-methoxy-3-sulfo-phenyl)-phenyl-phosphino]besylic acid Formula: C20H19O8PS2 MolecularWeight: 482.463821

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)P(C2=CC=CC=C2)C3=CC(=C(C=C3)OC)S(=O)(=O)O)S(=O)(=O)O

Isomeric SMILES

COC1=C(C=C(C=C1)P(C2=CC=CC=C2)C3=CC(=C(C=C3)OC)S(=O)(=O)O)S(=O)(=O)O

InChI

InChI=1S/C20H19O8PS2/c1-27-17-10-8-15(12-19(17)30(21,22)23)29(14-6-4-3-5-7-14)16-9-11-18(28-2)20(13-16)31(24,25)26/h3-13H,1-2H3,(H,21,22,23)(H,24,25,26)