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

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

Systemtic Name:2-[4-[4-(5-octylpyrimidin-2-yl)phenyl]phenyl]hexanoic acid
Openeye Name:2-[4-[4-(5-octylpyrimidin-2-yl)phenyl]phenyl]hexanoic acid
CAS Name:2-[4-[4-(5-octyl-2-pyrimidinyl)phenyl]phenyl]hexanoic acid
IUPAC Name:2-[4-[4-(5-octylpyrimidin-2-yl)phenyl]phenyl]hexanoic acid
Traditional Name:2-[4-[4-(5-octylpyrimidin-2-yl)phenyl]phenyl]hexanoic acid
Formula: C30H38N2O2
MolecularWeight: 458.63492
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)C3=CC=C(C=C3)C(CCCC)C(=O)O


Isomeric SMILES

CCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)C3=CC=C(C=C3)C(CCCC)C(=O)O


InChI

InChI=1S/C30H38N2O2/c1-3-5-7-8-9-10-11-23-21-31-29(32-22-23)27-19-15-25(16-20-27)24-13-17-26(18-14-24)28(30(33)34)12-6-4-2/h13-22,28H,3-12H2,1-2H3,(H,33,34)


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