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1,3,5,8-tetracyclohexylpyrene

1,3,5,8-tetracyclohexylpyrene

Systemtic Name:1,3,5,8-tetracyclohexylpyrene
Openeye Name:1,3,5,8-tetracyclohexylpyrene
CAS Name:1,3,5,8-tetracyclohexylpyrene
IUPAC Name:1,3,5,8-tetracyclohexylpyrene
Traditional Name:1,3,5,8-tetracyclohexylpyrene
Formula: C40H50
MolecularWeight: 530.825
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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=C3C=CC4=C(C=C(C5=CC(=C(C3=C45)C=C2)C6CCCCC6)C7CCCCC7)C8CCCCC8


Isomeric SMILES

C1CCC(CC1)C2=C3C=CC4=C(C=C(C5=CC(=C(C3=C45)C=C2)C6CCCCC6)C7CCCCC7)C8CCCCC8


InChI

InChI=1S/C40H50/c1-5-13-27(14-6-1)31-21-22-33-36(29-17-9-3-10-18-29)26-38-37(30-19-11-4-12-20-30)25-35(28-15-7-2-8-16-28)34-24-23-32(31)39(33)40(34)38/h21-30H,1-20H2


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