1,2,3,4,5,6-hexakis[2-(4-decylphenyl)ethyl]benzene

Systemtic Name: 1,2,3,4,5,6-hexakis[2-(4-decylphenyl)ethyl]benzene Openeye Name: 1,2,3,4,5,6-hexakis[2-(4-decylphenyl)ethyl]benzene CAS Name: 1,2,3,4,5,6-hexakis[2-(4-decylphenyl)ethyl]benzene IUPAC Name: 1,2,3,4,5,6-hexakis[2-(4-decylphenyl)ethyl]benzene Traditional Name: 1,2,3,4,5,6-hexakis[2-(4-decylphenyl)ethyl]benzene Formula: C114H174 MolecularWeight: 1544.60136

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC1=CC=C(C=C1)CCC2=C(C(=C(C(=C2CCC3=CC=C(C=C3)CCCCCCCCCC)CCC4=CC=C(C=C4)CCCCCCCCCC)CCC5=CC=C(C=C5)CCCCCCCCCC)CCC6=CC=C(C=C6)CCCCCCCCCC)CCC7=CC=C(C=C7)CCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCC1=CC=C(C=C1)CCC2=C(C(=C(C(=C2CCC3=CC=C(C=C3)CCCCCCCCCC)CCC4=CC=C(C=C4)CCCCCCCCCC)CCC5=CC=C(C=C5)CCCCCCCCCC)CCC6=CC=C(C=C6)CCCCCCCCCC)CCC7=CC=C(C=C7)CCCCCCCCCC

InChI

InChI=1S/C114H174/c1-7-13-19-25-31-37-43-49-55-97-61-73-103(74-62-97)85-91-109-110(92-86-104-75-63-98(64-76-104)56-50-44-38-32-26-20-14-8-2)112(94-88-106-79-67-100(68-80-106)58-52-46-40-34-28-22-16-10-4)114(96-90-108-83-71-102(72-84-108)60-54-48-42-36-30-24-18-12-6)113(95-89-107-81-69-101(70-82-107)59-53-47-41-35-29-23-17-11-5)111(109)93-87-105-77-65-99(66-78-105)57-51-45-39-33-27-21-15-9-3/h61-84H,7-60,85-96H2,1-6H3