1-[(E)-2,4-bis(octylsulfanyl)but-1-en-3-ynyl]sulfanyloctane

Systemtic Name: 1-[(E)-2,4-bis(octylsulfanyl)but-1-en-3-ynyl]sulfanyloctane Openeye Name: 1-[(E)-2,4-bis(octylsulfanyl)but-1-en-3-ynyl]sulfanyloctane CAS Name: 1-[[(E)-2,4-bis(octylthio)but-1-en-3-ynyl]thio]octane IUPAC Name: 1-[(E)-2,4-bis(octylsulfanyl)but-1-en-3-ynyl]sulfanyloctane Traditional Name: 1-[[(E)-2,4-bis(octylthio)but-1-en-3-ynyl]thio]octane Formula: C28H52S3 MolecularWeight: 484.90748

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCSC=C(C#CSCCCCCCCC)SCCCCCCCC

Isomeric SMILES

CCCCCCCCS/C=C(\C#CSCCCCCCCC)/SCCCCCCCC

InChI

InChI=1S/C28H52S3/c1-4-7-10-13-16-19-23-29-26-22-28(31-25-21-18-15-12-9-6-3)27-30-24-20-17-14-11-8-5-2/h27H,4-21,23-25H2,1-3H3/b28-27+