sodium (3,5-dimethylphenyl) [4-[(E)-4-(4-hydroxyphenyl)hex-3-en-3-yl]phenyl] phosphate

Systemtic Name: sodium (3,5-dimethylphenyl) [4-[(E)-4-(4-hydroxyphenyl)hex-3-en-3-yl]phenyl] phosphate Openeye Name: sodium (3,5-dimethylphenyl) [4-[(E)-1-ethyl-2-(4-hydroxyphenyl)but-1-enyl]phenyl] phosphate CAS Name: sodium (3,5-dimethylphenyl) [4-[(E)-4-(4-hydroxyphenyl)hex-3-en-3-yl]phenyl] phosphate IUPAC Name: sodium (3,5-dimethylphenyl) [4-[(E)-4-(4-hydroxyphenyl)hex-3-en-3-yl]phenyl] phosphate Traditional Name: sodium (3,5-dimethylphenyl) [4-[(E)-1-ethyl-2-(4-hydroxyphenyl)but-1-enyl]phenyl] phosphate Formula: C26H28NaO5P MolecularWeight: 474.461051

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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)C)C)C3=CC=C(C=C3)O.[Na+]

Isomeric SMILES

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

InChI

InChI=1S/C26H29O5P.Na/c1-5-25(20-7-11-22(27)12-8-20)26(6-2)21-9-13-23(14-10-21)30-32(28,29)31-24-16-18(3)15-19(4)17-24;/h7-17,27H,5-6H2,1-4H3,(H,28,29);/q;+1/p-1/b26-25+;