dioctadecyl 2-(3-tert-butyl-5-methyl-4-oxidanyl-phenyl)propanedioate

Systemtic Name: dioctadecyl 2-(3-tert-butyl-5-methyl-4-oxidanyl-phenyl)propanedioate Openeye Name: dioctadecyl 2-(3-tert-butyl-4-hydroxy-5-methyl-phenyl)propanedioate CAS Name: 2-(3-tert-butyl-4-hydroxy-5-methylphenyl)propanedioic acid dioctadecyl ester IUPAC Name: dioctadecyl 2-(3-tert-butyl-4-hydroxy-5-methylphenyl)propanedioate Traditional Name: 2-(3-tert-butyl-4-hydroxy-5-methyl-phenyl)malonic acid distearyl ester Formula: C50H90O5 MolecularWeight: 771.2466

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC(=O)C(C1=CC(=C(C(=C1)C(C)(C)C)O)C)C(=O)OCCCCCCCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC(=O)C(C1=CC(=C(C(=C1)C(C)(C)C)O)C)C(=O)OCCCCCCCCCCCCCCCCCC

InChI

InChI=1S/C50H90O5/c1-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39-54-48(52)46(44-41-43(3)47(51)45(42-44)50(4,5)6)49(53)55-40-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-2/h41-42,46,51H,7-40H2,1-6H3