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4-[2-[4-(4-heptylcyclohexyl)phenyl]ethyl]-2-methyl-benzenecarbonitrile
4-[2-[4-(4-heptylcyclohexyl)phenyl]ethyl]-2-methyl-benzenecarbonitrile
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Descriptors Computed from Structure
Canonical SMILES:
CCCCCCCC1CCC(CC1)C2=CC=C(C=C2)CCC3=CC(=C(C=C3)C#N)C
Isomeric SMILES
CCCCCCCC1CCC(CC1)C2=CC=C(C=C2)CCC3=CC(=C(C=C3)C#N)C
InChI
InChI=1S/C29H39N/c1-3-4-5-6-7-8-24-11-16-27(17-12-24)28-18-13-25(14-19-28)9-10-26-15-20-29(22-30)23(2)21-26/h13-15,18-21,24,27H,3-12,16-17H2,1-2H3
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- 4-[4-[2-[4-(4-butylcyclohexyl)phenyl]ethyl]-2-fluoranyl-phenyl]benzenecarbonitrile
