(4-nitrophenyl)methyl 2-(hydroxymethyl)-4-(phenylcarbonyloxy)pyrrolidine-1-carboxylate

Systemtic Name: (4-nitrophenyl)methyl 2-(hydroxymethyl)-4-(phenylcarbonyloxy)pyrrolidine-1-carboxylate Openeye Name: (4-nitrophenyl)methyl 4-benzoyloxy-2-(hydroxymethyl)pyrrolidine-1-carboxylate CAS Name: 4-benzoyloxy-2-(hydroxymethyl)-1-pyrrolidinecarboxylic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 4-benzoyloxy-2-(hydroxymethyl)pyrrolidine-1-carboxylate Traditional Name: 4-benzoyloxy-2-methylol-pyrrolidine-1-carboxylic acid (4-nitrobenzyl) ester Formula: C20H20N2O7 MolecularWeight: 400.382

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C1CO)C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])OC(=O)C3=CC=CC=C3

Isomeric SMILES

C1C(CN(C1CO)C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])OC(=O)C3=CC=CC=C3

InChI

InChI=1S/C20H20N2O7/c23-12-17-10-18(29-19(24)15-4-2-1-3-5-15)11-21(17)20(25)28-13-14-6-8-16(9-7-14)22(26)27/h1-9,17-18,23H,10-13H2