5,11-bis(4-hexylphenyl)-6,12-diphenyl-tetracene

Systemtic Name: 5,11-bis(4-hexylphenyl)-6,12-diphenyl-tetracene Openeye Name: 5,11-bis(4-hexylphenyl)-6,12-diphenyl-tetracene CAS Name: 5,11-bis(4-hexylphenyl)-6,12-diphenyltetracene IUPAC Name: 5,11-bis(4-hexylphenyl)-6,12-diphenyltetracene Traditional Name: 5,11-bis(4-hexylphenyl)-6,12-diphenyl-tetracene Formula: C54H52 MolecularWeight: 700.99068

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)C2=C3C=CC=CC3=C(C4=C(C5=CC=CC=C5C(=C24)C6=CC=CC=C6)C7=CC=C(C=C7)CCCCCC)C8=CC=CC=C8

Isomeric SMILES

CCCCCCC1=CC=C(C=C1)C2=C3C=CC=CC3=C(C4=C(C5=CC=CC=C5C(=C24)C6=CC=CC=C6)C7=CC=C(C=C7)CCCCCC)C8=CC=CC=C8

InChI

InChI=1S/C54H52/c1-3-5-7-11-21-39-31-35-43(36-32-39)51-47-29-19-17-27-45(47)50(42-25-15-10-16-26-42)54-52(44-37-33-40(34-38-44)22-12-8-6-4-2)48-30-20-18-28-46(48)49(53(51)54)41-23-13-9-14-24-41/h9-10,13-20,23-38H,3-8,11-12,21-22H2,1-2H3