1-(3,5-ditert-butyl-4-oxidanyl-phenyl)nonan-2-yl 2-sulfanylethanoate

Systemtic Name: 1-(3,5-ditert-butyl-4-oxidanyl-phenyl)nonan-2-yl 2-sulfanylethanoate Openeye Name: 1-[(3,5-ditert-butyl-4-hydroxy-phenyl)methyl]octyl 2-sulfanylacetate CAS Name: 2-mercaptoacetic acid 1-(3,5-ditert-butyl-4-hydroxyphenyl)nonan-2-yl ester IUPAC Name: 1-(3,5-ditert-butyl-4-hydroxyphenyl)nonan-2-yl 2-sulfanylacetate Traditional Name: 2-mercaptoacetic acid 1-(3,5-ditert-butyl-4-hydroxy-benzyl)octyl ester Formula: C25H42O3S MolecularWeight: 422.66418

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(CC1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C)OC(=O)CS

Isomeric SMILES

CCCCCCCC(CC1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C)OC(=O)CS

InChI

InChI=1S/C25H42O3S/c1-8-9-10-11-12-13-19(28-22(26)17-29)14-18-15-20(24(2,3)4)23(27)21(16-18)25(5,6)7/h15-16,19,27,29H,8-14,17H2,1-7H3