6-bromanyl-2-[2-(4-heptylphenyl)ethynyl]azulene

Systemtic Name: 6-bromanyl-2-[2-(4-heptylphenyl)ethynyl]azulene Openeye Name: 6-bromo-2-[2-(4-heptylphenyl)ethynyl]azulene CAS Name: 6-bromo-2-[2-(4-heptylphenyl)ethynyl]azulene IUPAC Name: 6-bromo-2-[2-(4-heptylphenyl)ethynyl]azulene Traditional Name: 6-bromo-2-[2-(4-heptylphenyl)ethynyl]azulene Formula: C25H25Br MolecularWeight: 405.37

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC=C(C=C1)C#CC2=CC3=CC=C(C=CC3=C2)Br

Isomeric SMILES

CCCCCCCC1=CC=C(C=C1)C#CC2=CC3=CC=C(C=CC3=C2)Br

InChI

InChI=1S/C25H25Br/c1-2-3-4-5-6-7-20-8-10-21(11-9-20)12-13-22-18-23-14-16-25(26)17-15-24(23)19-22/h8-11,14-19H,2-7H2,1H3