3-(3,5-ditert-butyl-4-oxidanyl-phenyl)propyl 1-ethylsulfanylcyclohexane-1-carboxylate

Systemtic Name: 3-(3,5-ditert-butyl-4-oxidanyl-phenyl)propyl 1-ethylsulfanylcyclohexane-1-carboxylate Openeye Name: 3-(3,5-ditert-butyl-4-hydroxy-phenyl)propyl 1-ethylsulfanylcyclohexanecarboxylate CAS Name: 1-(ethylthio)-1-cyclohexanecarboxylic acid 3-(3,5-ditert-butyl-4-hydroxyphenyl)propyl ester IUPAC Name: 3-(3,5-ditert-butyl-4-hydroxyphenyl)propyl 1-ethylsulfanylcyclohexane-1-carboxylate Traditional Name: 1-(ethylthio)cyclohexanecarboxylic acid 3-(3,5-ditert-butyl-4-hydroxy-phenyl)propyl ester Formula: C26H42O3S MolecularWeight: 434.67488

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1(CCCCC1)C(=O)OCCCC2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C

Isomeric SMILES

CCSC1(CCCCC1)C(=O)OCCCC2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C

InChI

InChI=1S/C26H42O3S/c1-8-30-26(14-10-9-11-15-26)23(28)29-16-12-13-19-17-20(24(2,3)4)22(27)21(18-19)25(5,6)7/h17-18,27H,8-16H2,1-7H3