methyl 2-(4-tert-butylphenyl)-2-hexylsulfanyl-ethanoate

Systemtic Name: methyl 2-(4-tert-butylphenyl)-2-hexylsulfanyl-ethanoate Openeye Name: methyl 2-(4-tert-butylphenyl)-2-hexylsulfanyl-acetate CAS Name: 2-(4-tert-butylphenyl)-2-(hexylthio)acetic acid methyl ester IUPAC Name: methyl 2-(4-tert-butylphenyl)-2-hexylsulfanylacetate Traditional Name: 2-(4-tert-butylphenyl)-2-(hexylthio)acetic acid methyl ester Formula: C19H30O2S MolecularWeight: 322.5053

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H30O2S/c1-6-7-8-9-14-22-17(18(20)21-5)15-10-12-16(13-11-15)19(2,3)4/h10-13,17H,6-9,14H2,1-5H3