1,1,6,6,6-pentakis-phenylhexa-2,4-diynylbenzene

Systemtic Name: 1,1,6,6,6-pentakis-phenylhexa-2,4-diynylbenzene Openeye Name: 1,1,6,6,6-pentakis-phenylhexa-2,4-diynylbenzene CAS Name: 1,1,6,6,6-pentakis-phenylhexa-2,4-diynylbenzene IUPAC Name: 1,1,6,6,6-pentakis-phenylhexa-2,4-diynylbenzene Traditional Name: 1,1,6,6,6-pentakis-phenylhexa-2,4-diynylbenzene Formula: C42H30 MolecularWeight: 534.6876

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C#CC#CC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

C1=CC=C(C=C1)C(C#CC#CC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C42H30/c1-7-21-35(22-8-1)41(36-23-9-2-10-24-36,37-25-11-3-12-26-37)33-19-20-34-42(38-27-13-4-14-28-38,39-29-15-5-16-30-39)40-31-17-6-18-32-40/h1-18,21-32H