2-[4-(5-propyl-2-pyrimidin-2-yl-phenyl)phenyl]ethanoate

Systemtic Name: 2-[4-(5-propyl-2-pyrimidin-2-yl-phenyl)phenyl]ethanoate Openeye Name: 2-[4-(5-propyl-2-pyrimidin-2-yl-phenyl)phenyl]acetate CAS Name: 2-[4-[5-propyl-2-(2-pyrimidinyl)phenyl]phenyl]acetate IUPAC Name: 2-[4-(5-propyl-2-pyrimidin-2-ylphenyl)phenyl]acetate Traditional Name: 2-[4-[5-propyl-2-(2-pyrimidyl)phenyl]phenyl]acetate Formula: C21H19N2O2- MolecularWeight: 331.38776

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=C(C=C1)C2=NC=CC=N2)C3=CC=C(C=C3)CC(=O)[O-]

Isomeric SMILES

CCCC1=CC(=C(C=C1)C2=NC=CC=N2)C3=CC=C(C=C3)CC(=O)[O-]

InChI

InChI=1S/C21H20N2O2/c1-2-4-15-7-10-18(21-22-11-3-12-23-21)19(13-15)17-8-5-16(6-9-17)14-20(24)25/h3,5-13H,2,4,14H2,1H3,(H,24,25)/p-1