[4-[2-(4-propylphenyl)pyrimidin-5-yl]phenyl] propanoate

Systemtic Name: [4-[2-(4-propylphenyl)pyrimidin-5-yl]phenyl] propanoate Openeye Name: [4-[2-(4-propylphenyl)pyrimidin-5-yl]phenyl] propanoate CAS Name: propanoic acid [4-[2-(4-propylphenyl)-5-pyrimidinyl]phenyl] ester IUPAC Name: [4-[2-(4-propylphenyl)pyrimidin-5-yl]phenyl] propanoate Traditional Name: propionic acid [4-[2-(4-propylphenyl)pyrimidin-5-yl]phenyl] ester Formula: C22H22N2O2 MolecularWeight: 346.42228

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H22N2O2/c1-3-5-16-6-8-18(9-7-16)22-23-14-19(15-24-22)17-10-12-20(13-11-17)26-21(25)4-2/h6-15H,3-5H2,1-2H3