(4-nitrophenyl)methyl 4-ethanoylsulfanyl-2-[[(4-nitrophenyl)methoxycarbonylamino]methyl]pyrrolidine-1-carboxylate

Systemtic Name: (4-nitrophenyl)methyl 4-ethanoylsulfanyl-2-[[(4-nitrophenyl)methoxycarbonylamino]methyl]pyrrolidine-1-carboxylate Openeye Name: (4-nitrophenyl)methyl 4-acetylsulfanyl-2-[[(4-nitrophenyl)methoxycarbonylamino]methyl]pyrrolidine-1-carboxylate CAS Name: 4-(acetylthio)-2-[[[(4-nitrophenyl)methoxy-oxomethyl]amino]methyl]-1-pyrrolidinecarboxylic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 4-acetylsulfanyl-2-[[(4-nitrophenyl)methoxycarbonylamino]methyl]pyrrolidine-1-carboxylate Traditional Name: 4-(acetylthio)-2-[[(4-nitrobenzyl)oxycarbonylamino]methyl]pyrrolidine-1-carboxylic acid (4-nitrobenzyl) ester Formula: C23H24N4O9S MolecularWeight: 532.52306

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SC1CC(N(C1)C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])CNC(=O)OCC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC(=O)SC1CC(N(C1)C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])CNC(=O)OCC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C23H24N4O9S/c1-15(28)37-21-10-20(11-24-22(29)35-13-16-2-6-18(7-3-16)26(31)32)25(12-21)23(30)36-14-17-4-8-19(9-5-17)27(33)34/h2-9,20-21H,10-14H2,1H3,(H,24,29)