ethyl 2,2-dimethyl-6-[4-(5-sulfanylpentoxy)phenoxy]hexanoate

Systemtic Name: ethyl 2,2-dimethyl-6-[4-(5-sulfanylpentoxy)phenoxy]hexanoate Openeye Name: ethyl 2,2-dimethyl-6-[4-(5-sulfanylpentoxy)phenoxy]hexanoate CAS Name: 6-[4-(5-mercaptopentoxy)phenoxy]-2,2-dimethylhexanoic acid ethyl ester IUPAC Name: ethyl 2,2-dimethyl-6-[4-(5-sulfanylpentoxy)phenoxy]hexanoate Traditional Name: 6-[4-(5-mercaptopentoxy)phenoxy]-2,2-dimethyl-hexanoic acid ethyl ester Formula: C21H34O4S MolecularWeight: 382.55726

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)(C)CCCCOC1=CC=C(C=C1)OCCCCCS

Isomeric SMILES

CCOC(=O)C(C)(C)CCCCOC1=CC=C(C=C1)OCCCCCS

InChI

InChI=1S/C21H34O4S/c1-4-23-20(22)21(2,3)14-6-8-16-25-19-12-10-18(11-13-19)24-15-7-5-9-17-26/h10-13,26H,4-9,14-17H2,1-3H3