2-(hydroxymethyl)-2-[(2-nonylphenoxy)-(2-nonylphenyl)methyl]propane-1,3-diol

Systemtic Name: 2-(hydroxymethyl)-2-[(2-nonylphenoxy)-(2-nonylphenyl)methyl]propane-1,3-diol Openeye Name: 2-(hydroxymethyl)-2-[(2-nonylphenoxy)-(2-nonylphenyl)methyl]propane-1,3-diol CAS Name: 2-(hydroxymethyl)-2-[(2-nonylphenoxy)-(2-nonylphenyl)methyl]propane-1,3-diol IUPAC Name: 2-(hydroxymethyl)-2-[(2-nonylphenoxy)-(2-nonylphenyl)methyl]propane-1,3-diol Traditional Name: 2-methylol-2-[(2-nonylphenoxy)-(2-nonylphenyl)methyl]propane-1,3-diol Formula: C35H56O4 MolecularWeight: 540.81674

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=CC=CC=C1C(C(CO)(CO)CO)OC2=CC=CC=C2CCCCCCCCC

Isomeric SMILES

CCCCCCCCCC1=CC=CC=C1C(C(CO)(CO)CO)OC2=CC=CC=C2CCCCCCCCC

InChI

InChI=1S/C35H56O4/c1-3-5-7-9-11-13-15-21-30-22-17-19-25-32(30)34(35(27-36,28-37)29-38)39-33-26-20-18-24-31(33)23-16-14-12-10-8-6-4-2/h17-20,22,24-26,34,36-38H,3-16,21,23,27-29H2,1-2H3