ethyl 2-(3,5-ditert-butylphenyl)sulfanylbutanoate

Systemtic Name: ethyl 2-(3,5-ditert-butylphenyl)sulfanylbutanoate Openeye Name: ethyl 2-(3,5-ditert-butylphenyl)sulfanylbutanoate CAS Name: 2-[(3,5-ditert-butylphenyl)thio]butanoic acid ethyl ester IUPAC Name: ethyl 2-(3,5-ditert-butylphenyl)sulfanylbutanoate Traditional Name: 2-[(3,5-ditert-butylphenyl)thio]butyric acid ethyl ester Formula: C20H32O2S MolecularWeight: 336.53188

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H32O2S/c1-9-17(18(21)22-10-2)23-16-12-14(19(3,4)5)11-15(13-16)20(6,7)8/h11-13,17H,9-10H2,1-8H3