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

Systemtic Name: (4-nitrophenyl)methyl 2-[2-[(4-nitrophenyl)methoxycarbonylamino]ethylsulfanylmethyl]-4-oxidanyl-pyrrolidine-1-carboxylate Openeye Name: (4-nitrophenyl)methyl 4-hydroxy-2-[2-[(4-nitrophenyl)methoxycarbonylamino]ethylsulfanylmethyl]pyrrolidine-1-carboxylate CAS Name: 4-hydroxy-2-[[2-[[(4-nitrophenyl)methoxy-oxomethyl]amino]ethylthio]methyl]-1-pyrrolidinecarboxylic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 4-hydroxy-2-[2-[(4-nitrophenyl)methoxycarbonylamino]ethylsulfanylmethyl]pyrrolidine-1-carboxylate Traditional Name: 4-hydroxy-2-[[2-[(4-nitrobenzyl)oxycarbonylamino]ethylthio]methyl]pyrrolidine-1-carboxylic acid (4-nitrobenzyl) ester Formula: C23H26N4O9S MolecularWeight: 534.53894

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C1CSCCNC(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])C(=O)OCC3=CC=C(C=C3)[N+](=O)[O-])O

Isomeric SMILES

C1C(CN(C1CSCCNC(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])C(=O)OCC3=CC=C(C=C3)[N+](=O)[O-])O

InChI

InChI=1S/C23H26N4O9S/c28-21-11-20(25(12-21)23(30)36-14-17-3-7-19(8-4-17)27(33)34)15-37-10-9-24-22(29)35-13-16-1-5-18(6-2-16)26(31)32/h1-8,20-21,28H,9-15H2,(H,24,29)