ethyl (E)-5-(3,5-ditert-butyl-4-oxidanyl-phenyl)sulfanylpent-2-enoate

Systemtic Name: ethyl (E)-5-(3,5-ditert-butyl-4-oxidanyl-phenyl)sulfanylpent-2-enoate Openeye Name: ethyl (E)-5-(3,5-ditert-butyl-4-hydroxy-phenyl)sulfanylpent-2-enoate CAS Name: (E)-5-[(3,5-ditert-butyl-4-hydroxyphenyl)thio]-2-pentenoic acid ethyl ester IUPAC Name: ethyl (E)-5-(3,5-ditert-butyl-4-hydroxyphenyl)sulfanylpent-2-enoate Traditional Name: (E)-5-[(3,5-ditert-butyl-4-hydroxy-phenyl)thio]pent-2-enoic acid ethyl ester Formula: C21H32O3S MolecularWeight: 364.54198

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CCCSC1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C

Isomeric SMILES

CCOC(=O)/C=C/CCSC1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C

InChI

InChI=1S/C21H32O3S/c1-8-24-18(22)11-9-10-12-25-15-13-16(20(2,3)4)19(23)17(14-15)21(5,6)7/h9,11,13-14,23H,8,10,12H2,1-7H3/b11-9+