[4-[4-(5-cyanopyrimidin-2-yl)phenyl]phenyl] propanoate

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OC1=CC=C(C=C1)C2=CC=C(C=C2)C3=NC=C(C=N3)C#N

Isomeric SMILES

CCC(=O)OC1=CC=C(C=C1)C2=CC=C(C=C2)C3=NC=C(C=N3)C#N

InChI

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