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1-bromanyl-5,6,7-tridodecoxy-9-methyl-phenanthrene

1-bromanyl-5,6,7-tridodecoxy-9-methyl-phenanthrene

Systemtic Name:1-bromanyl-5,6,7-tridodecoxy-9-methyl-phenanthrene
Openeye Name:1-bromo-5,6,7-tridodecoxy-9-methyl-phenanthrene
CAS Name:1-bromo-5,6,7-tridodecoxy-9-methylphenanthrene
IUPAC Name:1-bromo-5,6,7-tridodecoxy-9-methylphenanthrene
Traditional Name:1-bromo-5,6,7-trilauryloxy-9-methyl-phenanthrene
Formula: C51H83BrO3
MolecularWeight: 824.10692
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC1=CC2=C(C=C3C(=C2C(=C1OCCCCCCCCCCCC)OCCCCCCCCCCCC)C=CC=C3Br)C


Isomeric SMILES

CCCCCCCCCCCCOC1=CC2=C(C=C3C(=C2C(=C1OCCCCCCCCCCCC)OCCCCCCCCCCCC)C=CC=C3Br)C


InChI

InChI=1S/C51H83BrO3/c1-5-8-11-14-17-20-23-26-29-32-38-53-48-42-45-43(4)41-46-44(36-35-37-47(46)52)49(45)51(55-40-34-31-28-25-22-19-16-13-10-7-3)50(48)54-39-33-30-27-24-21-18-15-12-9-6-2/h35-37,41-42H,5-34,38-40H2,1-4H3


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