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

Systemtic Name: 3-[(3,5-ditert-butyl-4-oxidanyl-phenyl)methylsulfanyl]propanal Openeye Name: 3-[(3,5-ditert-butyl-4-hydroxy-phenyl)methylsulfanyl]propanal CAS Name: 3-[(3,5-ditert-butyl-4-hydroxyphenyl)methylthio]propanal IUPAC Name: 3-[(3,5-ditert-butyl-4-hydroxyphenyl)methylsulfanyl]propanal Traditional Name: 3-[(3,5-ditert-butyl-4-hydroxy-benzyl)thio]propionaldehyde Formula: C18H28O2S MolecularWeight: 308.47872

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CSCCC=O

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CSCCC=O

InChI

InChI=1S/C18H28O2S/c1-17(2,3)14-10-13(12-21-9-7-8-19)11-15(16(14)20)18(4,5)6/h8,10-11,20H,7,9,12H2,1-6H3