3-(6-chloranylpyridin-3-yl)-3-oxidanyl-2-[[4-(trifluoromethyl)phenyl]methyl]propanoate

Systemtic Name: 3-(6-chloranylpyridin-3-yl)-3-oxidanyl-2-[[4-(trifluoromethyl)phenyl]methyl]propanoate Openeye Name: 3-(6-chloro-3-pyridyl)-3-hydroxy-2-[[4-(trifluoromethyl)phenyl]methyl]propanoate CAS Name: 3-(6-chloro-3-pyridinyl)-3-hydroxy-2-[[4-(trifluoromethyl)phenyl]methyl]propanoate IUPAC Name: 3-(6-chloropyridin-3-yl)-3-hydroxy-2-[[4-(trifluoromethyl)phenyl]methyl]propanoate Traditional Name: 3-(6-chloro-3-pyridyl)-3-hydroxy-2-[4-(trifluoromethyl)benzyl]propionate Formula: C16H12ClF3NO3- MolecularWeight: 358.71959

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC(C(C2=CN=C(C=C2)Cl)O)C(=O)[O-])C(F)(F)F

Isomeric SMILES

C1=CC(=CC=C1CC(C(C2=CN=C(C=C2)Cl)O)C(=O)[O-])C(F)(F)F

InChI

InChI=1S/C16H13ClF3NO3/c17-13-6-3-10(8-21-13)14(22)12(15(23)24)7-9-1-4-11(5-2-9)16(18,19)20/h1-6,8,12,14,22H,7H2,(H,23,24)/p-1