sodium [3-[3-(2,4-diacetyloxyphenyl)-3-oxidanylidene-propyl]phenyl] phenyl phosphate

Systemtic Name: sodium [3-[3-(2,4-diacetyloxyphenyl)-3-oxidanylidene-propyl]phenyl] phenyl phosphate Openeye Name: sodium [3-[3-(2,4-diacetoxyphenyl)-3-oxo-propyl]phenyl] phenyl phosphate CAS Name: sodium [3-[3-(2,4-diacetyloxyphenyl)-3-oxopropyl]phenyl] phenyl phosphate IUPAC Name: sodium [3-[3-(2,4-diacetyloxyphenyl)-3-oxopropyl]phenyl] phenyl phosphate Traditional Name: sodium [3-[3-(2,4-diacetoxyphenyl)-3-keto-propyl]phenyl] phenyl phosphate Formula: C25H22NaO9P MolecularWeight: 520.400311

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC(=C(C=C1)C(=O)CCC2=CC(=CC=C2)OP(=O)([O-])OC3=CC=CC=C3)OC(=O)C.[Na+]

Isomeric SMILES

CC(=O)OC1=CC(=C(C=C1)C(=O)CCC2=CC(=CC=C2)OP(=O)([O-])OC3=CC=CC=C3)OC(=O)C.[Na+]

InChI

InChI=1S/C25H23O9P.Na/c1-17(26)31-21-12-13-23(25(16-21)32-18(2)27)24(28)14-11-19-7-6-10-22(15-19)34-35(29,30)33-20-8-4-3-5-9-20;/h3-10,12-13,15-16H,11,14H2,1-2H3,(H,29,30);/q;+1/p-1