(2S,3S)-2-(4,6-dimethylpyrimidin-2-yl)oxy-3-(4-fluorophenyl)-3-methoxy-3-phenyl-propanoate

Systemtic Name: (2S,3S)-2-(4,6-dimethylpyrimidin-2-yl)oxy-3-(4-fluorophenyl)-3-methoxy-3-phenyl-propanoate Openeye Name: (2S,3S)-2-(4,6-dimethylpyrimidin-2-yl)oxy-3-(4-fluorophenyl)-3-methoxy-3-phenyl-propanoate CAS Name: (2S,3S)-2-[(4,6-dimethyl-2-pyrimidinyl)oxy]-3-(4-fluorophenyl)-3-methoxy-3-phenylpropanoate IUPAC Name: (2S,3S)-2-(4,6-dimethylpyrimidin-2-yl)oxy-3-(4-fluorophenyl)-3-methoxy-3-phenylpropanoate Traditional Name: (2S,3S)-2-(4,6-dimethylpyrimidin-2-yl)oxy-3-(4-fluorophenyl)-3-methoxy-3-phenyl-propionate Formula: C22H20FN2O4- MolecularWeight: 395.403603

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)OC(C(=O)[O-])C(C2=CC=CC=C2)(C3=CC=C(C=C3)F)OC)C

Isomeric SMILES

CC1=CC(=NC(=N1)O[C@H](C(=O)[O-])[C@](C2=CC=CC=C2)(C3=CC=C(C=C3)F)OC)C

InChI

InChI=1S/C22H21FN2O4/c1-14-13-15(2)25-21(24-14)29-19(20(26)27)22(28-3,16-7-5-4-6-8-16)17-9-11-18(23)12-10-17/h4-13,19H,1-3H3,(H,26,27)/p-1/t19-,22+/m1/s1