sodium [4-[(E)-2,3-diphenylprop-2-enoyl]-3-methoxy-phenyl] (4-fluorophenyl) phosphate

Systemtic Name: sodium [4-[(E)-2,3-diphenylprop-2-enoyl]-3-methoxy-phenyl] (4-fluorophenyl) phosphate Openeye Name: sodium [4-[(E)-2,3-diphenylprop-2-enoyl]-3-methoxy-phenyl] (4-fluorophenyl) phosphate CAS Name: sodium (4-fluorophenyl) [3-methoxy-4-[(E)-1-oxo-2,3-diphenylprop-2-enyl]phenyl] phosphate IUPAC Name: sodium [4-[(E)-2,3-diphenylprop-2-enoyl]-3-methoxyphenyl] (4-fluorophenyl) phosphate Traditional Name: sodium [4-[(E)-2,3-diphenylacryloyl]-3-methoxy-phenyl] (4-fluorophenyl) phosphate Formula: C28H21FNaO6P MolecularWeight: 526.424674

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)OP(=O)([O-])OC2=CC=C(C=C2)F)C(=O)C(=CC3=CC=CC=C3)C4=CC=CC=C4.[Na+]

Isomeric SMILES

COC1=C(C=CC(=C1)OP(=O)([O-])OC2=CC=C(C=C2)F)C(=O)/C(=C/C3=CC=CC=C3)/C4=CC=CC=C4.[Na+]

InChI

InChI=1S/C28H22FO6P.Na/c1-33-27-19-24(35-36(31,32)34-23-14-12-22(29)13-15-23)16-17-25(27)28(30)26(21-10-6-3-7-11-21)18-20-8-4-2-5-9-20;/h2-19H,1H3,(H,31,32);/q;+1/p-1/b26-18+;