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1-dodecylsulfanylhept-2-ynylbenzene

1-dodecylsulfanylhept-2-ynylbenzene

Systemtic Name:1-dodecylsulfanylhept-2-ynylbenzene
Openeye Name:1-dodecylsulfanylhept-2-ynylbenzene
CAS Name:1-(dodecylthio)hept-2-ynylbenzene
IUPAC Name:1-dodecylsulfanylhept-2-ynylbenzene
Traditional Name:1-(laurylthio)hept-2-ynylbenzene
Formula: C25H40S
MolecularWeight: 372.6501
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCSC(C#CCCCC)C1=CC=CC=C1


Isomeric SMILES

CCCCCCCCCCCCSC(C#CCCCC)C1=CC=CC=C1


InChI

InChI=1S/C25H40S/c1-3-5-7-9-10-11-12-13-14-19-23-26-25(22-18-8-6-4-2)24-20-16-15-17-21-24/h15-17,20-21,25H,3-14,19,23H2,1-2H3


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