7-[4-(5-propyl-2-pyrimidin-2-yl-phenyl)phenyl]heptanoic acid

Systemtic Name: 7-[4-(5-propyl-2-pyrimidin-2-yl-phenyl)phenyl]heptanoic acid Openeye Name: 7-[4-(5-propyl-2-pyrimidin-2-yl-phenyl)phenyl]heptanoic acid CAS Name: 7-[4-[5-propyl-2-(2-pyrimidinyl)phenyl]phenyl]heptanoic acid IUPAC Name: 7-[4-(5-propyl-2-pyrimidin-2-ylphenyl)phenyl]heptanoic acid Traditional Name: 7-[4-[5-propyl-2-(2-pyrimidyl)phenyl]phenyl]enanthic acid Formula: C26H30N2O2 MolecularWeight: 402.5286

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=C(C=C1)C2=NC=CC=N2)C3=CC=C(C=C3)CCCCCCC(=O)O

Isomeric SMILES

CCCC1=CC(=C(C=C1)C2=NC=CC=N2)C3=CC=C(C=C3)CCCCCCC(=O)O

InChI

InChI=1S/C26H30N2O2/c1-2-8-21-13-16-23(26-27-17-7-18-28-26)24(19-21)22-14-11-20(12-15-22)9-5-3-4-6-10-25(29)30/h7,11-19H,2-6,8-10H2,1H3,(H,29,30)