2-[(4E)-3-(2-ethoxy-2-oxidanylidene-ethyl)sulfanyl-2-oxidanyl-4-tetradecylidene-cyclohexyl]ethanoate

Systemtic Name: 2-[(4E)-3-(2-ethoxy-2-oxidanylidene-ethyl)sulfanyl-2-oxidanyl-4-tetradecylidene-cyclohexyl]ethanoate Openeye Name: 2-[(4E)-3-(2-ethoxy-2-oxo-ethyl)sulfanyl-2-hydroxy-4-tetradecylidene-cyclohexyl]acetate CAS Name: 2-[(4E)-3-[(2-ethoxy-2-oxoethyl)thio]-2-hydroxy-4-tetradecylidenecyclohexyl]acetate IUPAC Name: 2-[(4E)-3-(2-ethoxy-2-oxoethyl)sulfanyl-2-hydroxy-4-tetradecylidenecyclohexyl]acetate Traditional Name: 2-[(4E)-3-[(2-ethoxy-2-keto-ethyl)thio]-2-hydroxy-4-tetradecylidene-cyclohexyl]acetate Formula: C26H45O5S- MolecularWeight: 469.6975

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC=C1CCC(C(C1SCC(=O)OCC)O)CC(=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCC/C=C/1\CCC(C(C1SCC(=O)OCC)O)CC(=O)[O-]

InChI

InChI=1S/C26H46O5S/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-21-17-18-22(19-23(27)28)25(30)26(21)32-20-24(29)31-4-2/h16,22,25-26,30H,3-15,17-20H2,1-2H3,(H,27,28)/p-1/b21-16+