(2S)-3,3-bis(4-fluorophenyl)-2-(4-methylpyrimidin-2-yl)oxy-3-propoxy-propanoic acid

Systemtic Name: (2S)-3,3-bis(4-fluorophenyl)-2-(4-methylpyrimidin-2-yl)oxy-3-propoxy-propanoic acid Openeye Name: (2S)-3,3-bis(4-fluorophenyl)-2-(4-methylpyrimidin-2-yl)oxy-3-propoxy-propanoic acid CAS Name: (2S)-3,3-bis(4-fluorophenyl)-2-[(4-methyl-2-pyrimidinyl)oxy]-3-propoxypropanoic acid IUPAC Name: (2S)-3,3-bis(4-fluorophenyl)-2-(4-methylpyrimidin-2-yl)oxy-3-propoxypropanoic acid Traditional Name: (2S)-3,3-bis(4-fluorophenyl)-2-(4-methylpyrimidin-2-yl)oxy-3-propoxy-propionic acid Formula: C23H22F2N2O4 MolecularWeight: 428.428586

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(C1=CC=C(C=C1)F)(C2=CC=C(C=C2)F)C(C(=O)O)OC3=NC=CC(=N3)C

Isomeric SMILES

CCCOC(C1=CC=C(C=C1)F)(C2=CC=C(C=C2)F)[C@@H](C(=O)O)OC3=NC=CC(=N3)C

InChI

InChI=1S/C23H22F2N2O4/c1-3-14-30-23(16-4-8-18(24)9-5-16,17-6-10-19(25)11-7-17)20(21(28)29)31-22-26-13-12-15(2)27-22/h4-13,20H,3,14H2,1-2H3,(H,28,29)/t20-/m1/s1