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2,3,6,7,10-pentahexoxytriphenylene

2,3,6,7,10-pentahexoxytriphenylene

Systemtic Name:2,3,6,7,10-pentahexoxytriphenylene
Openeye Name:2,3,6,7,10-pentahexoxytriphenylene
CAS Name:2,3,6,7,10-pentahexoxytriphenylene
IUPAC Name:2,3,6,7,10-pentahexoxytriphenylene
Traditional Name:2,3,6,7,10-pentahexoxytriphenylene
Formula: C48H72O5
MolecularWeight: 729.08228
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC2=C(C=C1)C3=CC(=C(C=C3C4=CC(=C(C=C42)OCCCCCC)OCCCCCC)OCCCCCC)OCCCCCC


Isomeric SMILES

CCCCCCOC1=CC2=C(C=C1)C3=CC(=C(C=C3C4=CC(=C(C=C42)OCCCCCC)OCCCCCC)OCCCCCC)OCCCCCC


InChI

InChI=1S/C48H72O5/c1-6-11-16-21-28-49-38-26-27-39-40(33-38)42-35-46(51-30-23-18-13-8-3)48(53-32-25-20-15-10-5)37-44(42)43-36-47(52-31-24-19-14-9-4)45(34-41(39)43)50-29-22-17-12-7-2/h26-27,33-37H,6-25,28-32H2,1-5H3


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