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3-[4-(5-pentyl-2-pyrimidin-2-yl-phenyl)phenyl]propanoic acid

3-[4-(5-pentyl-2-pyrimidin-2-yl-phenyl)phenyl]propanoic acid

Systemtic Name:3-[4-(5-pentyl-2-pyrimidin-2-yl-phenyl)phenyl]propanoic acid
Openeye Name:3-[4-(5-pentyl-2-pyrimidin-2-yl-phenyl)phenyl]propanoic acid
CAS Name:3-[4-[5-pentyl-2-(2-pyrimidinyl)phenyl]phenyl]propanoic acid
IUPAC Name:3-[4-(5-pentyl-2-pyrimidin-2-ylphenyl)phenyl]propanoic acid
Traditional Name:3-[4-[5-amyl-2-(2-pyrimidyl)phenyl]phenyl]propionic acid
Formula: C24H26N2O2
MolecularWeight: 374.47544
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC(=C(C=C1)C2=NC=CC=N2)C3=CC=C(C=C3)CCC(=O)O


Isomeric SMILES

CCCCCC1=CC(=C(C=C1)C2=NC=CC=N2)C3=CC=C(C=C3)CCC(=O)O


InChI

InChI=1S/C24H26N2O2/c1-2-3-4-6-19-9-13-21(24-25-15-5-16-26-24)22(17-19)20-11-7-18(8-12-20)10-14-23(27)28/h5,7-9,11-13,15-17H,2-4,6,10,14H2,1H3,(H,27,28)


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