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1-[1-adamantyl-(5-chloranyl-2-methyl-phenyl)methyl]adamantane

1-[1-adamantyl-(5-chloranyl-2-methyl-phenyl)methyl]adamantane

Systemtic Name:1-[1-adamantyl-(5-chloranyl-2-methyl-phenyl)methyl]adamantane
Openeye Name:1-[1-adamantyl-(5-chloro-2-methyl-phenyl)methyl]adamantane
CAS Name:1-[1-adamantyl-(5-chloro-2-methylphenyl)methyl]adamantane
IUPAC Name:1-[1-adamantyl-(5-chloro-2-methylphenyl)methyl]adamantane
Traditional Name:1-[1-adamantyl-(5-chloro-2-methyl-phenyl)methyl]adamantane
Formula: C28H37Cl
MolecularWeight: 409.04638
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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)C(C23CC4CC(C2)CC(C4)C3)C56CC7CC(C5)CC(C7)C6


Isomeric SMILES

CC1=C(C=C(C=C1)Cl)C(C23CC4CC(C2)CC(C4)C3)C56CC7CC(C5)CC(C7)C6


InChI

InChI=1S/C28H37Cl/c1-17-2-3-24(29)10-25(17)26(27-11-18-4-19(12-27)6-20(5-18)13-27)28-14-21-7-22(15-28)9-23(8-21)16-28/h2-3,10,18-23,26H,4-9,11-16H2,1H3


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