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

Systemtic Name: 1,2,3,4,5,6-hexakis[2-(4-nonoxyphenyl)ethyl]benzene Openeye Name: 1,2,3,4,5,6-hexakis[2-(4-nonoxyphenyl)ethyl]benzene CAS Name: 1,2,3,4,5,6-hexakis[2-(4-nonoxyphenyl)ethyl]benzene IUPAC Name: 1,2,3,4,5,6-hexakis[2-(4-nonoxyphenyl)ethyl]benzene Traditional Name: 1,2,3,4,5,6-hexakis[2-(4-nonoxyphenyl)ethyl]benzene Formula: C108H162O6 MolecularWeight: 1556.43828

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCOC1=CC=C(C=C1)CCC2=C(C(=C(C(=C2CCC3=CC=C(C=C3)OCCCCCCCCC)CCC4=CC=C(C=C4)OCCCCCCCCC)CCC5=CC=C(C=C5)OCCCCCCCCC)CCC6=CC=C(C=C6)OCCCCCCCCC)CCC7=CC=C(C=C7)OCCCCCCCCC

Isomeric SMILES

CCCCCCCCCOC1=CC=C(C=C1)CCC2=C(C(=C(C(=C2CCC3=CC=C(C=C3)OCCCCCCCCC)CCC4=CC=C(C=C4)OCCCCCCCCC)CCC5=CC=C(C=C5)OCCCCCCCCC)CCC6=CC=C(C=C6)OCCCCCCCCC)CCC7=CC=C(C=C7)OCCCCCCCCC

InChI

InChI=1S/C108H162O6/c1-7-13-19-25-31-37-43-85-109-97-67-49-91(50-68-97)61-79-103-104(80-62-92-51-69-98(70-52-92)110-86-44-38-32-26-20-14-8-2)106(82-64-94-55-73-100(74-56-94)112-88-46-40-34-28-22-16-10-4)108(84-66-96-59-77-102(78-60-96)114-90-48-42-36-30-24-18-12-6)107(83-65-95-57-75-101(76-58-95)113-89-47-41-35-29-23-17-11-5)105(103)81-63-93-53-71-99(72-54-93)111-87-45-39-33-27-21-15-9-3/h49-60,67-78H,7-48,61-66,79-90H2,1-6H3