(2S)-1-[4-(furan-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]pyrrolidine-2-carboxylate

Systemtic Name: (2S)-1-[4-(furan-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]pyrrolidine-2-carboxylate Openeye Name: (2S)-1-[4-(2-furyl)-6-(trifluoromethyl)pyrimidin-2-yl]pyrrolidine-2-carboxylate CAS Name: (2S)-1-[4-(2-furanyl)-6-(trifluoromethyl)-2-pyrimidinyl]-2-pyrrolidinecarboxylate IUPAC Name: (2S)-1-[4-(furan-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]pyrrolidine-2-carboxylate Traditional Name: (2S)-1-[4-(2-furyl)-6-(trifluoromethyl)pyrimidin-2-yl]pyrrolidine-2-carboxylate Formula: C14H11F3N3O3- MolecularWeight: 326.25065

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C2=NC(=CC(=N2)C(F)(F)F)C3=CC=CO3)C(=O)[O-]

Isomeric SMILES

C1C[C@H](N(C1)C2=NC(=CC(=N2)C(F)(F)F)C3=CC=CO3)C(=O)[O-]

InChI

InChI=1S/C14H12F3N3O3/c15-14(16,17)11-7-8(10-4-2-6-23-10)18-13(19-11)20-5-1-3-9(20)12(21)22/h2,4,6-7,9H,1,3,5H2,(H,21,22)/p-1/t9-/m0/s1