O3-tert-butyl O1-[1-(3-tert-butyl-4-oxidanyl-phenyl)pentan-2-yl] propanedioate

Systemtic Name: O3-tert-butyl O1-[1-(3-tert-butyl-4-oxidanyl-phenyl)pentan-2-yl] propanedioate Openeye Name: O3-tert-butyl O1-[1-[(3-tert-butyl-4-hydroxy-phenyl)methyl]butyl] propanedioate CAS Name: propanedioic acid O3-tert-butyl ester O1-[1-(3-tert-butyl-4-hydroxyphenyl)pentan-2-yl] ester IUPAC Name: 3-O-tert-butyl 1-O-[1-(3-tert-butyl-4-hydroxyphenyl)pentan-2-yl] propanedioate Traditional Name: malonic acid O3-tert-butyl ester O1-[1-(3-tert-butyl-4-hydroxy-benzyl)butyl] ester Formula: C22H34O5 MolecularWeight: 378.50236

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(CC1=CC(=C(C=C1)O)C(C)(C)C)OC(=O)CC(=O)OC(C)(C)C

Isomeric SMILES

CCCC(CC1=CC(=C(C=C1)O)C(C)(C)C)OC(=O)CC(=O)OC(C)(C)C

InChI

InChI=1S/C22H34O5/c1-8-9-16(26-19(24)14-20(25)27-22(5,6)7)12-15-10-11-18(23)17(13-15)21(2,3)4/h10-11,13,16,23H,8-9,12,14H2,1-7H3