tert-butyl 3-[2-(4-cyanophenoxy)pyrimidin-4-yl]-3-(4-fluorophenyl)propanoate

Systemtic Name: tert-butyl 3-[2-(4-cyanophenoxy)pyrimidin-4-yl]-3-(4-fluorophenyl)propanoate Openeye Name: tert-butyl 3-[2-(4-cyanophenoxy)pyrimidin-4-yl]-3-(4-fluorophenyl)propanoate CAS Name: 3-[2-(4-cyanophenoxy)-4-pyrimidinyl]-3-(4-fluorophenyl)propanoic acid tert-butyl ester IUPAC Name: tert-butyl 3-[2-(4-cyanophenoxy)pyrimidin-4-yl]-3-(4-fluorophenyl)propanoate Traditional Name: 3-[2-(4-cyanophenoxy)pyrimidin-4-yl]-3-(4-fluorophenyl)propionic acid tert-butyl ester Formula: C24H22FN3O3 MolecularWeight: 419.448183

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CC(C1=CC=C(C=C1)F)C2=NC(=NC=C2)OC3=CC=C(C=C3)C#N

Isomeric SMILES

CC(C)(C)OC(=O)CC(C1=CC=C(C=C1)F)C2=NC(=NC=C2)OC3=CC=C(C=C3)C#N

InChI

InChI=1S/C24H22FN3O3/c1-24(2,3)31-22(29)14-20(17-6-8-18(25)9-7-17)21-12-13-27-23(28-21)30-19-10-4-16(15-26)5-11-19/h4-13,20H,14H2,1-3H3