O4-[2-ethyl-2-(trioxidanylsulfanyl)hexa-3,5-diynyl] O1-hexa-3,5-diynyl 2-ethylbutanedioate

Systemtic Name: O4-[2-ethyl-2-(trioxidanylsulfanyl)hexa-3,5-diynyl] O1-hexa-3,5-diynyl 2-ethylbutanedioate Openeye Name: O4-[2-ethyl-2-(trioxidanylsulfanyl)hexa-3,5-diynyl] O1-hexa-3,5-diynyl 2-ethylbutanedioate CAS Name: 2-ethylbutanedioic acid O4-[2-ethyl-2-(trioxidanylthio)hexa-3,5-diynyl] ester O1-hexa-3,5-diynyl ester IUPAC Name: 4-O-[2-ethyl-2-(trioxidanylsulfanyl)hexa-3,5-diynyl] 1-O-hexa-3,5-diynyl 2-ethylbutanedioate Traditional Name: 2-ethylsuccinic acid O4-[2-ethyl-2-(trioxidanylthio)hexa-3,5-diynyl] ester O1-hexa-3,5-diynyl ester Formula: C20H22O7S MolecularWeight: 406.44948

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC(=O)OCC(CC)(C#CC#C)SOOO)C(=O)OCCC#CC#C

Isomeric SMILES

CCC(CC(=O)OCC(CC)(C#CC#C)SOOO)C(=O)OCCC#CC#C

InChI

InChI=1S/C20H22O7S/c1-5-9-11-12-14-24-19(22)17(7-3)15-18(21)25-16-20(8-4,13-10-6-2)28-27-26-23/h1-2,17,23H,7-8,12,14-16H2,3-4H3