4-(2,2-dimethylpropanoyloxy)-2-[2-(4-fluorophenyl)ethanoyl]pyrazolidine-1-carboxylic acid

Systemtic Name: 4-(2,2-dimethylpropanoyloxy)-2-[2-(4-fluorophenyl)ethanoyl]pyrazolidine-1-carboxylic acid Openeye Name: 4-(2,2-dimethylpropanoyloxy)-2-[2-(4-fluorophenyl)acetyl]pyrazolidine-1-carboxylic acid CAS Name: 4-(2,2-dimethyl-1-oxopropoxy)-2-[2-(4-fluorophenyl)-1-oxoethyl]-1-pyrazolidinecarboxylic acid IUPAC Name: 4-(2,2-dimethylpropanoyloxy)-2-[2-(4-fluorophenyl)acetyl]pyrazolidine-1-carboxylic acid Traditional Name: 2-[2-(4-fluorophenyl)acetyl]-4-pivaloyloxy-pyrazolidine-1-carboxylic acid Formula: C17H21FN2O5 MolecularWeight: 352.357443

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)OC1CN(N(C1)C(=O)O)C(=O)CC2=CC=C(C=C2)F

Isomeric SMILES

CC(C)(C)C(=O)OC1CN(N(C1)C(=O)O)C(=O)CC2=CC=C(C=C2)F

InChI

InChI=1S/C17H21FN2O5/c1-17(2,3)15(22)25-13-9-19(20(10-13)16(23)24)14(21)8-11-4-6-12(18)7-5-11/h4-7,13H,8-10H2,1-3H3,(H,23,24)