(phenylmethyl) 2-[2-(4-fluorophenyl)ethanoyl]-4-(4-nitrophenoxy)carbonyloxy-pyrazolidine-1-carboxylate

Systemtic Name: (phenylmethyl) 2-[2-(4-fluorophenyl)ethanoyl]-4-(4-nitrophenoxy)carbonyloxy-pyrazolidine-1-carboxylate Openeye Name: benzyl 2-[2-(4-fluorophenyl)acetyl]-4-(4-nitrophenoxy)carbonyloxy-pyrazolidine-1-carboxylate CAS Name: 2-[2-(4-fluorophenyl)-1-oxoethyl]-4-[(4-nitrophenoxy)-oxomethoxy]-1-pyrazolidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[2-(4-fluorophenyl)acetyl]-4-(4-nitrophenoxy)carbonyloxypyrazolidine-1-carboxylate Traditional Name: 2-[2-(4-fluorophenyl)acetyl]-4-(4-nitrophenoxy)carbonyloxy-pyrazolidine-1-carboxylic acid benzyl ester Formula: C26H22FN3O8 MolecularWeight: 523.466583

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(N1C(=O)CC2=CC=C(C=C2)F)C(=O)OCC3=CC=CC=C3)OC(=O)OC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1C(CN(N1C(=O)CC2=CC=C(C=C2)F)C(=O)OCC3=CC=CC=C3)OC(=O)OC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C26H22FN3O8/c27-20-8-6-18(7-9-20)14-24(31)28-15-23(16-29(28)25(32)36-17-19-4-2-1-3-5-19)38-26(33)37-22-12-10-21(11-13-22)30(34)35/h1-13,23H,14-17H2