2-[18-(2,6-ditert-butyl-4-ethyl-phenyl)octadecoxymethyl]-2-(hydroxymethyl)propane-1,3-diol

Systemtic Name: 2-[18-(2,6-ditert-butyl-4-ethyl-phenyl)octadecoxymethyl]-2-(hydroxymethyl)propane-1,3-diol Openeye Name: 2-[18-(2,6-ditert-butyl-4-ethyl-phenyl)octadecoxymethyl]-2-(hydroxymethyl)propane-1,3-diol CAS Name: 2-[18-(2,6-ditert-butyl-4-ethylphenyl)octadecoxymethyl]-2-(hydroxymethyl)propane-1,3-diol IUPAC Name: 2-[18-(2,6-ditert-butyl-4-ethylphenyl)octadecoxymethyl]-2-(hydroxymethyl)propane-1,3-diol Traditional Name: 2-[18-(2,6-ditert-butyl-4-ethyl-phenyl)octadecoxymethyl]-2-methylol-propane-1,3-diol Formula: C39H72O4 MolecularWeight: 604.98658

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C(=C1)C(C)(C)C)CCCCCCCCCCCCCCCCCCOCC(CO)(CO)CO)C(C)(C)C

Isomeric SMILES

CCC1=CC(=C(C(=C1)C(C)(C)C)CCCCCCCCCCCCCCCCCCOCC(CO)(CO)CO)C(C)(C)C

InChI

InChI=1S/C39H72O4/c1-8-33-27-35(37(2,3)4)34(36(28-33)38(5,6)7)25-23-21-19-17-15-13-11-9-10-12-14-16-18-20-22-24-26-43-32-39(29-40,30-41)31-42/h27-28,40-42H,8-26,29-32H2,1-7H3