(phenylmethyl) 2-[2-chloranyl-4-(trifluoromethyl)pyrimidin-5-yl]carbonylpyrazolidine-1-carboxylate

Systemtic Name: (phenylmethyl) 2-[2-chloranyl-4-(trifluoromethyl)pyrimidin-5-yl]carbonylpyrazolidine-1-carboxylate Openeye Name: benzyl 2-[2-chloro-4-(trifluoromethyl)pyrimidine-5-carbonyl]pyrazolidine-1-carboxylate CAS Name: 2-[[2-chloro-4-(trifluoromethyl)-5-pyrimidinyl]-oxomethyl]-1-pyrazolidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[2-chloro-4-(trifluoromethyl)pyrimidine-5-carbonyl]pyrazolidine-1-carboxylate Traditional Name: 2-[2-chloro-4-(trifluoromethyl)pyrimidine-5-carbonyl]pyrazolidine-1-carboxylic acid benzyl ester Formula: C17H14ClF3N4O3 MolecularWeight: 414.76627

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(N(C1)C(=O)OCC2=CC=CC=C2)C(=O)C3=CN=C(N=C3C(F)(F)F)Cl

Isomeric SMILES

C1CN(N(C1)C(=O)OCC2=CC=CC=C2)C(=O)C3=CN=C(N=C3C(F)(F)F)Cl

InChI

InChI=1S/C17H14ClF3N4O3/c18-15-22-9-12(13(23-15)17(19,20)21)14(26)24-7-4-8-25(24)16(27)28-10-11-5-2-1-3-6-11/h1-3,5-6,9H,4,7-8,10H2