tert-butyl 3-(2-chloranylpyrimidin-4-yl)-3-(4-fluorophenyl)propanoate

Systemtic Name: tert-butyl 3-(2-chloranylpyrimidin-4-yl)-3-(4-fluorophenyl)propanoate Openeye Name: tert-butyl 3-(2-chloropyrimidin-4-yl)-3-(4-fluorophenyl)propanoate CAS Name: 3-(2-chloro-4-pyrimidinyl)-3-(4-fluorophenyl)propanoic acid tert-butyl ester IUPAC Name: tert-butyl 3-(2-chloropyrimidin-4-yl)-3-(4-fluorophenyl)propanoate Traditional Name: 3-(2-chloropyrimidin-4-yl)-3-(4-fluorophenyl)propionic acid tert-butyl ester Formula: C17H18ClFN2O2 MolecularWeight: 336.788423

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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)Cl

Isomeric SMILES

CC(C)(C)OC(=O)CC(C1=CC=C(C=C1)F)C2=NC(=NC=C2)Cl

InChI

InChI=1S/C17H18ClFN2O2/c1-17(2,3)23-15(22)10-13(11-4-6-12(19)7-5-11)14-8-9-20-16(18)21-14/h4-9,13H,10H2,1-3H3