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2-[4-[4-(5-heptylpyrimidin-2-yl)phenyl]phenyl]hexanoic acid

2-[4-[4-(5-heptylpyrimidin-2-yl)phenyl]phenyl]hexanoic acid

Systemtic Name:2-[4-[4-(5-heptylpyrimidin-2-yl)phenyl]phenyl]hexanoic acid
Openeye Name:2-[4-[4-(5-heptylpyrimidin-2-yl)phenyl]phenyl]hexanoic acid
CAS Name:2-[4-[4-(5-heptyl-2-pyrimidinyl)phenyl]phenyl]hexanoic acid
IUPAC Name:2-[4-[4-(5-heptylpyrimidin-2-yl)phenyl]phenyl]hexanoic acid
Traditional Name:2-[4-[4-(5-heptylpyrimidin-2-yl)phenyl]phenyl]hexanoic acid
Formula: C29H36N2O2
MolecularWeight: 444.60834
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)C3=CC=C(C=C3)C(CCCC)C(=O)O


Isomeric SMILES

CCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)C3=CC=C(C=C3)C(CCCC)C(=O)O


InChI

InChI=1S/C29H36N2O2/c1-3-5-7-8-9-10-22-20-30-28(31-21-22)26-18-14-24(15-19-26)23-12-16-25(17-13-23)27(29(32)33)11-6-4-2/h12-21,27H,3-11H2,1-2H3,(H,32,33)


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