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1-ethynyl-6-octyl-pyrene

1-ethynyl-6-octyl-pyrene

Systemtic Name:1-ethynyl-6-octyl-pyrene
Openeye Name:1-ethynyl-6-octyl-pyrene
CAS Name:1-ethynyl-6-octylpyrene
IUPAC Name:1-ethynyl-6-octylpyrene
Traditional Name:1-ethynyl-6-octyl-pyrene
Formula: C26H26
MolecularWeight: 338.48464
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=C2C=CC3=C4C2=C(C=C1)C=CC4=C(C=C3)C#C


Isomeric SMILES

CCCCCCCCC1=C2C=CC3=C4C2=C(C=C1)C=CC4=C(C=C3)C#C


InChI

InChI=1S/C26H26/c1-3-5-6-7-8-9-10-20-12-14-22-15-17-23-19(4-2)11-13-21-16-18-24(20)26(22)25(21)23/h2,11-18H,3,5-10H2,1H3


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