(2S,3S)-3-(4-fluorophenyl)-3-methoxy-2-(4-methylpyrimidin-2-yl)oxy-3-phenyl-propanoic acid

Systemtic Name: (2S,3S)-3-(4-fluorophenyl)-3-methoxy-2-(4-methylpyrimidin-2-yl)oxy-3-phenyl-propanoic acid Openeye Name: (2S,3S)-3-(4-fluorophenyl)-3-methoxy-2-(4-methylpyrimidin-2-yl)oxy-3-phenyl-propanoic acid CAS Name: (2S,3S)-3-(4-fluorophenyl)-3-methoxy-2-[(4-methyl-2-pyrimidinyl)oxy]-3-phenylpropanoic acid IUPAC Name: (2S,3S)-3-(4-fluorophenyl)-3-methoxy-2-(4-methylpyrimidin-2-yl)oxy-3-phenylpropanoic acid Traditional Name: (2S,3S)-3-(4-fluorophenyl)-3-methoxy-2-(4-methylpyrimidin-2-yl)oxy-3-phenyl-propionic acid Formula: C21H19FN2O4 MolecularWeight: 382.384963

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC=C1)OC(C(=O)O)C(C2=CC=CC=C2)(C3=CC=C(C=C3)F)OC

Isomeric SMILES

CC1=NC(=NC=C1)O[C@H](C(=O)O)[C@](C2=CC=CC=C2)(C3=CC=C(C=C3)F)OC

InChI

InChI=1S/C21H19FN2O4/c1-14-12-13-23-20(24-14)28-18(19(25)26)21(27-2,15-6-4-3-5-7-15)16-8-10-17(22)11-9-16/h3-13,18H,1-2H3,(H,25,26)/t18-,21+/m1/s1