2-(hydroxymethyl)-2-[(4-octylphenoxy)-(4-octylphenyl)methyl]propane-1,3-diol

Systemtic Name: 2-(hydroxymethyl)-2-[(4-octylphenoxy)-(4-octylphenyl)methyl]propane-1,3-diol Openeye Name: 2-(hydroxymethyl)-2-[(4-octylphenoxy)-(4-octylphenyl)methyl]propane-1,3-diol CAS Name: 2-(hydroxymethyl)-2-[(4-octylphenoxy)-(4-octylphenyl)methyl]propane-1,3-diol IUPAC Name: 2-(hydroxymethyl)-2-[(4-octylphenoxy)-(4-octylphenyl)methyl]propane-1,3-diol Traditional Name: 2-methylol-2-[(4-octylphenoxy)-(4-octylphenyl)methyl]propane-1,3-diol Formula: C33H52O4 MolecularWeight: 512.76358

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(C=C1)C(C(CO)(CO)CO)OC2=CC=C(C=C2)CCCCCCCC

Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)C(C(CO)(CO)CO)OC2=CC=C(C=C2)CCCCCCCC

InChI

InChI=1S/C33H52O4/c1-3-5-7-9-11-13-15-28-17-21-30(22-18-28)32(33(25-34,26-35)27-36)37-31-23-19-29(20-24-31)16-14-12-10-8-6-4-2/h17-24,32,34-36H,3-16,25-27H2,1-2H3