O2-tert-butyl O1-[(4-nitrophenyl)methyl] 2-ethyl-4-[(4-methoxyphenyl)methylsulfanyl]pyrrolidine-1,2-dicarboxylate

Systemtic Name: O2-tert-butyl O1-[(4-nitrophenyl)methyl] 2-ethyl-4-[(4-methoxyphenyl)methylsulfanyl]pyrrolidine-1,2-dicarboxylate Openeye Name: O2-tert-butyl O1-[(4-nitrophenyl)methyl] 2-ethyl-4-[(4-methoxyphenyl)methylsulfanyl]pyrrolidine-1,2-dicarboxylate CAS Name: 2-ethyl-4-[(4-methoxyphenyl)methylthio]pyrrolidine-1,2-dicarboxylic acid O2-tert-butyl ester O1-[(4-nitrophenyl)methyl] ester IUPAC Name: 2-O-tert-butyl 1-O-[(4-nitrophenyl)methyl] 2-ethyl-4-[(4-methoxyphenyl)methylsulfanyl]pyrrolidine-1,2-dicarboxylate Traditional Name: 2-ethyl-4-(p-anisylthio)pyrrolidine-1,2-dicarboxylic acid O2-tert-butyl ester O1-(4-nitrobenzyl) ester Formula: C27H34N2O7S MolecularWeight: 530.63306

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1(CC(CN1C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])SCC3=CC=C(C=C3)OC)C(=O)OC(C)(C)C

Isomeric SMILES

CCC1(CC(CN1C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])SCC3=CC=C(C=C3)OC)C(=O)OC(C)(C)C

InChI

InChI=1S/C27H34N2O7S/c1-6-27(24(30)36-26(2,3)4)15-23(37-18-20-9-13-22(34-5)14-10-20)16-28(27)25(31)35-17-19-7-11-21(12-8-19)29(32)33/h7-14,23H,6,15-18H2,1-5H3