2-ethylhexyl 4-ethyl-2-sulfanyl-octanoate

Systemtic Name: 2-ethylhexyl 4-ethyl-2-sulfanyl-octanoate Openeye Name: 2-ethylhexyl 4-ethyl-2-sulfanyl-octanoate CAS Name: 4-ethyl-2-mercaptooctanoic acid 2-ethylhexyl ester IUPAC Name: 2-ethylhexyl 4-ethyl-2-sulfanyloctanoate Traditional Name: 4-ethyl-2-mercapto-caprylic acid 2-ethylhexyl ester Formula: C18H36O2S MolecularWeight: 316.54224

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CC(C(=O)OCC(CC)CCCC)S

Isomeric SMILES

CCCCC(CC)CC(C(=O)OCC(CC)CCCC)S

InChI

InChI=1S/C18H36O2S/c1-5-9-11-15(7-3)13-17(21)18(19)20-14-16(8-4)12-10-6-2/h15-17,21H,5-14H2,1-4H3