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

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

Systemtic Name:2-[4-[4-(5-octylpyrimidin-2-yl)phenyl]phenyl]butanoic acid
Openeye Name:2-[4-[4-(5-octylpyrimidin-2-yl)phenyl]phenyl]butanoic acid
CAS Name:2-[4-[4-(5-octyl-2-pyrimidinyl)phenyl]phenyl]butanoic acid
IUPAC Name:2-[4-[4-(5-octylpyrimidin-2-yl)phenyl]phenyl]butanoic acid
Traditional Name:2-[4-[4-(5-octylpyrimidin-2-yl)phenyl]phenyl]butyric acid
Formula: C28H34N2O2
MolecularWeight: 430.58176
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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(CC)C(=O)O


Isomeric SMILES

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


InChI

InChI=1S/C28H34N2O2/c1-3-5-6-7-8-9-10-21-19-29-27(30-20-21)25-17-13-23(14-18-25)22-11-15-24(16-12-22)26(4-2)28(31)32/h11-20,26H,3-10H2,1-2H3,(H,31,32)


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