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

Systemtic Name: [5-[4-(4-cyanophenyl)phenyl]pyrimidin-2-yl] propanoate Openeye Name: [5-[4-(4-cyanophenyl)phenyl]pyrimidin-2-yl] propanoate CAS Name: propanoic acid [5-[4-(4-cyanophenyl)phenyl]-2-pyrimidinyl] ester IUPAC Name: [5-[4-(4-cyanophenyl)phenyl]pyrimidin-2-yl] propanoate Traditional Name: propionic acid [5-[4-(4-cyanophenyl)phenyl]pyrimidin-2-yl] ester Formula: C20H15N3O2 MolecularWeight: 329.352

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OC1=NC=C(C=N1)C2=CC=C(C=C2)C3=CC=C(C=C3)C#N

Isomeric SMILES

CCC(=O)OC1=NC=C(C=N1)C2=CC=C(C=C2)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C20H15N3O2/c1-2-19(24)25-20-22-12-18(13-23-20)17-9-7-16(8-10-17)15-5-3-14(11-21)4-6-15/h3-10,12-13H,2H2,1H3