sodium [4-[(E)-4-(4-methoxyphenyl)hex-3-en-3-yl]phenyl] phenyl phosphate

Systemtic Name: sodium [4-[(E)-4-(4-methoxyphenyl)hex-3-en-3-yl]phenyl] phenyl phosphate Openeye Name: sodium [4-[(E)-1-ethyl-2-(4-methoxyphenyl)but-1-enyl]phenyl] phenyl phosphate CAS Name: sodium [4-[(E)-4-(4-methoxyphenyl)hex-3-en-3-yl]phenyl] phenyl phosphate IUPAC Name: sodium [4-[(E)-4-(4-methoxyphenyl)hex-3-en-3-yl]phenyl] phenyl phosphate Traditional Name: sodium [4-[(E)-1-ethyl-2-(4-methoxyphenyl)but-1-enyl]phenyl] phenyl phosphate Formula: C25H26NaO5P MolecularWeight: 460.434471

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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)OC.[Na+]

Isomeric SMILES

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

InChI

InChI=1S/C25H27O5P.Na/c1-4-24(19-11-15-21(28-3)16-12-19)25(5-2)20-13-17-23(18-14-20)30-31(26,27)29-22-9-7-6-8-10-22;/h6-18H,4-5H2,1-3H3,(H,26,27);/q;+1/p-1/b25-24+;