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

Systemtic Name: (4-nitrophenyl)methyl 4-ethanoylsulfanyl-2-[2-[(4-nitrophenyl)methoxycarbonylamino]ethoxymethyl]pyrrolidine-1-carboxylate Openeye Name: (4-nitrophenyl)methyl 4-acetylsulfanyl-2-[2-[(4-nitrophenyl)methoxycarbonylamino]ethoxymethyl]pyrrolidine-1-carboxylate CAS Name: 4-(acetylthio)-2-[2-[[(4-nitrophenyl)methoxy-oxomethyl]amino]ethoxymethyl]-1-pyrrolidinecarboxylic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 4-acetylsulfanyl-2-[2-[(4-nitrophenyl)methoxycarbonylamino]ethoxymethyl]pyrrolidine-1-carboxylate Traditional Name: 4-(acetylthio)-2-[2-[(4-nitrobenzyl)oxycarbonylamino]ethoxymethyl]pyrrolidine-1-carboxylic acid (4-nitrobenzyl) ester Formula: C25H28N4O10S MolecularWeight: 576.57562

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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-])COCCNC(=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-])COCCNC(=O)OCC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C25H28N4O10S/c1-17(30)40-23-12-22(27(13-23)25(32)39-15-19-4-8-21(9-5-19)29(35)36)16-37-11-10-26-24(31)38-14-18-2-6-20(7-3-18)28(33)34/h2-9,22-23H,10-16H2,1H3,(H,26,31)