3-[(3,5-ditert-butyl-4-oxidanyl-phenyl)methylsulfanyl]butanal

Systemtic Name: 3-[(3,5-ditert-butyl-4-oxidanyl-phenyl)methylsulfanyl]butanal Openeye Name: 3-[(3,5-ditert-butyl-4-hydroxy-phenyl)methylsulfanyl]butanal CAS Name: 3-[(3,5-ditert-butyl-4-hydroxyphenyl)methylthio]butanal IUPAC Name: 3-[(3,5-ditert-butyl-4-hydroxyphenyl)methylsulfanyl]butanal Traditional Name: 3-[(3,5-ditert-butyl-4-hydroxy-benzyl)thio]butyraldehyde Formula: C19H30O2S MolecularWeight: 322.5053

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CC=O)SCC1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C

Isomeric SMILES

CC(CC=O)SCC1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C

InChI

InChI=1S/C19H30O2S/c1-13(8-9-20)22-12-14-10-15(18(2,3)4)17(21)16(11-14)19(5,6)7/h9-11,13,21H,8,12H2,1-7H3