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

Systemtic Name: 1,2,3,4,5,6-hexakis[2-(4-heptoxyphenyl)ethyl]benzene Openeye Name: 1,2,3,4,5,6-hexakis[2-(4-heptoxyphenyl)ethyl]benzene CAS Name: 1,2,3,4,5,6-hexakis[2-(4-heptoxyphenyl)ethyl]benzene IUPAC Name: 1,2,3,4,5,6-hexakis[2-(4-heptoxyphenyl)ethyl]benzene Traditional Name: 1,2,3,4,5,6-hexakis[2-(4-heptoxyphenyl)ethyl]benzene Formula: C96H138O6 MolecularWeight: 1388.11932

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=C(C=C1)CCC2=C(C(=C(C(=C2CCC3=CC=C(C=C3)OCCCCCCC)CCC4=CC=C(C=C4)OCCCCCCC)CCC5=CC=C(C=C5)OCCCCCCC)CCC6=CC=C(C=C6)OCCCCCCC)CCC7=CC=C(C=C7)OCCCCCCC

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)CCC2=C(C(=C(C(=C2CCC3=CC=C(C=C3)OCCCCCCC)CCC4=CC=C(C=C4)OCCCCCCC)CCC5=CC=C(C=C5)OCCCCCCC)CCC6=CC=C(C=C6)OCCCCCCC)CCC7=CC=C(C=C7)OCCCCCCC

InChI

InChI=1S/C96H138O6/c1-7-13-19-25-31-73-97-85-55-37-79(38-56-85)49-67-91-92(68-50-80-39-57-86(58-40-80)98-74-32-26-20-14-8-2)94(70-52-82-43-61-88(62-44-82)100-76-34-28-22-16-10-4)96(72-54-84-47-65-90(66-48-84)102-78-36-30-24-18-12-6)95(71-53-83-45-63-89(64-46-83)101-77-35-29-23-17-11-5)93(91)69-51-81-41-59-87(60-42-81)99-75-33-27-21-15-9-3/h37-48,55-66H,7-36,49-54,67-78H2,1-6H3