4-(2-chloranylpyrimidin-4-yl)oxy-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 4-(2-chloranylpyrimidin-4-yl)oxy-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-tert-butoxycarbonyl-4-(2-chloropyrimidin-4-yl)oxy-pyrrolidine-2-carboxylic acid CAS Name: 4-[(2-chloro-4-pyrimidinyl)oxy]-1-[(2-methylpropan-2-yl)oxy-oxomethyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 4-(2-chloropyrimidin-4-yl)oxy-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-tert-butoxycarbonyl-4-(2-chloropyrimidin-4-yl)oxy-proline Formula: C14H18ClN3O5 MolecularWeight: 343.76282

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CC(CC1C(=O)O)OC2=NC(=NC=C2)Cl

Isomeric SMILES

CC(C)(C)OC(=O)N1CC(CC1C(=O)O)OC2=NC(=NC=C2)Cl

InChI

InChI=1S/C14H18ClN3O5/c1-14(2,3)23-13(21)18-7-8(6-9(18)11(19)20)22-10-4-5-16-12(15)17-10/h4-5,8-9H,6-7H2,1-3H3,(H,19,20)