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tetrakis(2-ethylhexyl) triphenylene-2,3,6,10-tetracarboxylate

tetrakis(2-ethylhexyl) triphenylene-2,3,6,10-tetracarboxylate

Systemtic Name:tetrakis(2-ethylhexyl) triphenylene-2,3,6,10-tetracarboxylate
Openeye Name:tetrakis(2-ethylhexyl) triphenylene-2,3,6,10-tetracarboxylate
CAS Name:triphenylene-2,3,6,10-tetracarboxylic acid tetrakis(2-ethylhexyl) ester
IUPAC Name:tetrakis(2-ethylhexyl) triphenylene-2,3,6,10-tetracarboxylate
Traditional Name:triphenylene-2,3,6,10-tetracarboxylic acid tetrakis(2-ethylhexyl) ester
Formula: C54H76O8
MolecularWeight: 853.17644
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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)COC(=O)C1=CC2=C(C=C1)C3=CC(=C(C=C3C4=C2C=CC(=C4)C(=O)OCC(CC)CCCC)C(=O)OCC(CC)CCCC)C(=O)OCC(CC)CCCC


Isomeric SMILES

CCCCC(CC)COC(=O)C1=CC2=C(C=C1)C3=CC(=C(C=C3C4=C2C=CC(=C4)C(=O)OCC(CC)CCCC)C(=O)OCC(CC)CCCC)C(=O)OCC(CC)CCCC


InChI

InChI=1S/C54H76O8/c1-9-17-21-37(13-5)33-59-51(55)41-26-28-44-45(29-41)43-27-25-42(52(56)60-34-38(14-6)22-18-10-2)30-46(43)48-32-50(54(58)62-36-40(16-8)24-20-12-4)49(31-47(44)48)53(57)61-35-39(15-7)23-19-11-3/h25-32,37-40H,9-24,33-36H2,1-8H3


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