9-bromanyl-10-[2-[4-(4-pentylphenyl)phenyl]ethynyl]anthracene

Systemtic Name: 9-bromanyl-10-[2-[4-(4-pentylphenyl)phenyl]ethynyl]anthracene Openeye Name: 9-bromo-10-[2-[4-(4-pentylphenyl)phenyl]ethynyl]anthracene CAS Name: 9-bromo-10-[2-[4-(4-pentylphenyl)phenyl]ethynyl]anthracene IUPAC Name: 9-bromo-10-[2-[4-(4-pentylphenyl)phenyl]ethynyl]anthracene Traditional Name: 9-[2-[4-(4-amylphenyl)phenyl]ethynyl]-10-bromo-anthracene Formula: C33H27Br MolecularWeight: 503.47148

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C#CC3=C4C=CC=CC4=C(C5=CC=CC=C53)Br

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C#CC3=C4C=CC=CC4=C(C5=CC=CC=C53)Br

InChI

InChI=1S/C33H27Br/c1-2-3-4-9-24-14-19-26(20-15-24)27-21-16-25(17-22-27)18-23-30-28-10-5-7-12-31(28)33(34)32-13-8-6-11-29(30)32/h5-8,10-17,19-22H,2-4,9H2,1H3