sodium [4-[(E)-4-[4-(2-ethoxy-2-oxidanylidene-ethoxy)phenyl]hex-3-en-3-yl]phenyl] phenyl phosphate

Systemtic Name: sodium [4-[(E)-4-[4-(2-ethoxy-2-oxidanylidene-ethoxy)phenyl]hex-3-en-3-yl]phenyl] phenyl phosphate Openeye Name: sodium [4-[(E)-2-[4-(2-ethoxy-2-oxo-ethoxy)phenyl]-1-ethyl-but-1-enyl]phenyl] phenyl phosphate CAS Name: sodium [4-[(E)-4-[4-(2-ethoxy-2-oxoethoxy)phenyl]hex-3-en-3-yl]phenyl] phenyl phosphate IUPAC Name: sodium [4-[(E)-4-[4-(2-ethoxy-2-oxoethoxy)phenyl]hex-3-en-3-yl]phenyl] phenyl phosphate Traditional Name: sodium [4-[(E)-2-[4-(2-ethoxy-2-keto-ethoxy)phenyl]-1-ethyl-but-1-enyl]phenyl] phenyl phosphate Formula: C28H30NaO7P MolecularWeight: 532.497131

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=C(CC)C1=CC=C(C=C1)OP(=O)([O-])OC2=CC=CC=C2)C3=CC=C(C=C3)OCC(=O)OCC.[Na+]

Isomeric SMILES

CC/C(=C(/CC)\C1=CC=C(C=C1)OP(=O)([O-])OC2=CC=CC=C2)/C3=CC=C(C=C3)OCC(=O)OCC.[Na+]

InChI

InChI=1S/C28H31O7P.Na/c1-4-26(21-12-16-23(17-13-21)33-20-28(29)32-6-3)27(5-2)22-14-18-25(19-15-22)35-36(30,31)34-24-10-8-7-9-11-24;/h7-19H,4-6,20H2,1-3H3,(H,30,31);/q;+1/p-1/b27-26+;