ethyl 2-(3,5-ditert-butylphenyl)sulfanyl-2-methyl-octanoate

Systemtic Name: ethyl 2-(3,5-ditert-butylphenyl)sulfanyl-2-methyl-octanoate Openeye Name: ethyl 2-(3,5-ditert-butylphenyl)sulfanyl-2-methyl-octanoate CAS Name: 2-[(3,5-ditert-butylphenyl)thio]-2-methyloctanoic acid ethyl ester IUPAC Name: ethyl 2-(3,5-ditert-butylphenyl)sulfanyl-2-methyloctanoate Traditional Name: 2-[(3,5-ditert-butylphenyl)thio]-2-methyl-caprylic acid ethyl ester Formula: C25H42O2S MolecularWeight: 406.66478

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H42O2S/c1-10-12-13-14-15-25(9,22(26)27-11-2)28-21-17-19(23(3,4)5)16-20(18-21)24(6,7)8/h16-18H,10-15H2,1-9H3