(5-butyl-9-heptyl-7-hexyl-3-methyl-7-pentyl-3-phenyl-5-propyl-heptadecan-9-yl)benzene

Systemtic Name: (5-butyl-9-heptyl-7-hexyl-3-methyl-7-pentyl-3-phenyl-5-propyl-heptadecan-9-yl)benzene Openeye Name: (3-butyl-1-ethyl-7-heptyl-5-hexyl-1-methyl-5-pentyl-7-phenyl-3-propyl-pentadecyl)benzene CAS Name: (5-butyl-9-heptyl-7-hexyl-3-methyl-7-pentyl-3-phenyl-5-propylheptadecan-9-yl)benzene IUPAC Name: (5-butyl-9-heptyl-7-hexyl-3-methyl-7-pentyl-3-phenyl-5-propylheptadecan-9-yl)benzene Traditional Name: (5-amyl-3-butyl-1-ethyl-7-heptyl-5-hexyl-1-methyl-7-phenyl-3-propyl-pentadecyl)benzene Formula: C55H96 MolecularWeight: 757.35074

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(CCCCCCC)(CC(CCCCC)(CCCCCC)CC(CCC)(CCCC)CC(C)(CC)C1=CC=CC=C1)C2=CC=CC=C2

Isomeric SMILES

CCCCCCCCC(CCCCCCC)(CC(CCCCC)(CCCCCC)CC(CCC)(CCCC)CC(C)(CC)C1=CC=CC=C1)C2=CC=CC=C2

InChI

InChI=1S/C55H96/c1-9-16-21-24-26-36-46-55(45-35-25-22-17-10-2,51-39-31-28-32-40-51)49-54(43-33-19-12-4,44-34-23-18-11-3)48-53(41-14-6,42-20-13-5)47-52(8,15-7)50-37-29-27-30-38-50/h27-32,37-40H,9-26,33-36,41-49H2,1-8H3