(2S)-3,3-bis(4-chlorophenyl)-2-(4,6-dimethylpyrimidin-2-yl)oxy-3-methoxy-propanoate

Systemtic Name: (2S)-3,3-bis(4-chlorophenyl)-2-(4,6-dimethylpyrimidin-2-yl)oxy-3-methoxy-propanoate Openeye Name: (2S)-3,3-bis(4-chlorophenyl)-2-(4,6-dimethylpyrimidin-2-yl)oxy-3-methoxy-propanoate CAS Name: (2S)-3,3-bis(4-chlorophenyl)-2-[(4,6-dimethyl-2-pyrimidinyl)oxy]-3-methoxypropanoate IUPAC Name: (2S)-3,3-bis(4-chlorophenyl)-2-(4,6-dimethylpyrimidin-2-yl)oxy-3-methoxypropanoate Traditional Name: (2S)-3,3-bis(4-chlorophenyl)-2-(4,6-dimethylpyrimidin-2-yl)oxy-3-methoxy-propionate Formula: C22H19Cl2N2O4- MolecularWeight: 446.30326

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H20Cl2N2O4/c1-13-12-14(2)26-21(25-13)30-19(20(27)28)22(29-3,15-4-8-17(23)9-5-15)16-6-10-18(24)11-7-16/h4-12,19H,1-3H3,(H,27,28)/p-1/t19-/m1/s1