methyl 2-[2-(3,5-ditert-butylphenyl)sulfanylcyclooctyl]sulfanylethanoate

Systemtic Name: methyl 2-[2-(3,5-ditert-butylphenyl)sulfanylcyclooctyl]sulfanylethanoate Openeye Name: methyl 2-[2-(3,5-ditert-butylphenyl)sulfanylcyclooctyl]sulfanylacetate CAS Name: 2-[[2-[(3,5-ditert-butylphenyl)thio]cyclooctyl]thio]acetic acid methyl ester IUPAC Name: methyl 2-[2-(3,5-ditert-butylphenyl)sulfanylcyclooctyl]sulfanylacetate Traditional Name: 2-[[2-[(3,5-ditert-butylphenyl)thio]cyclooctyl]thio]acetic acid methyl ester Formula: C25H40O2S2 MolecularWeight: 436.7139

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1)SC2CCCCCCC2SCC(=O)OC)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1)SC2CCCCCCC2SCC(=O)OC)C(C)(C)C

InChI

InChI=1S/C25H40O2S2/c1-24(2,3)18-14-19(25(4,5)6)16-20(15-18)29-22-13-11-9-8-10-12-21(22)28-17-23(26)27-7/h14-16,21-22H,8-13,17H2,1-7H3