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

Systemtic Name: 1,2,3,4,5,6-hexakis[2-(4-butylphenyl)ethyl]benzene Openeye Name: 1,2,3,4,5,6-hexakis[2-(4-butylphenyl)ethyl]benzene CAS Name: 1,2,3,4,5,6-hexakis[2-(4-butylphenyl)ethyl]benzene IUPAC Name: 1,2,3,4,5,6-hexakis[2-(4-butylphenyl)ethyl]benzene Traditional Name: 1,2,3,4,5,6-hexakis[2-(4-butylphenyl)ethyl]benzene Formula: C78H102 MolecularWeight: 1039.64448

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)CCC2=C(C(=C(C(=C2CCC3=CC=C(C=C3)CCCC)CCC4=CC=C(C=C4)CCCC)CCC5=CC=C(C=C5)CCCC)CCC6=CC=C(C=C6)CCCC)CCC7=CC=C(C=C7)CCCC

Isomeric SMILES

CCCCC1=CC=C(C=C1)CCC2=C(C(=C(C(=C2CCC3=CC=C(C=C3)CCCC)CCC4=CC=C(C=C4)CCCC)CCC5=CC=C(C=C5)CCCC)CCC6=CC=C(C=C6)CCCC)CCC7=CC=C(C=C7)CCCC

InChI

InChI=1S/C78H102/c1-7-13-19-61-25-37-67(38-26-61)49-55-73-74(56-50-68-39-27-62(28-40-68)20-14-8-2)76(58-52-70-43-31-64(32-44-70)22-16-10-4)78(60-54-72-47-35-66(36-48-72)24-18-12-6)77(59-53-71-45-33-65(34-46-71)23-17-11-5)75(73)57-51-69-41-29-63(30-42-69)21-15-9-3/h25-48H,7-24,49-60H2,1-6H3