3-(3,5-ditert-butyl-4-oxidanyl-phenyl)sulfanylbutanal

Systemtic Name: 3-(3,5-ditert-butyl-4-oxidanyl-phenyl)sulfanylbutanal Openeye Name: 3-(3,5-ditert-butyl-4-hydroxy-phenyl)sulfanylbutanal CAS Name: 3-[(3,5-ditert-butyl-4-hydroxyphenyl)thio]butanal IUPAC Name: 3-(3,5-ditert-butyl-4-hydroxyphenyl)sulfanylbutanal Traditional Name: 3-[(3,5-ditert-butyl-4-hydroxy-phenyl)thio]butyraldehyde Formula: C18H28O2S MolecularWeight: 308.47872

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC=O)SC1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C

Isomeric SMILES

CC(CC=O)SC1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C

InChI

InChI=1S/C18H28O2S/c1-12(8-9-19)21-13-10-14(17(2,3)4)16(20)15(11-13)18(5,6)7/h9-12,20H,8H2,1-7H3