(4-nitrophenyl)methyl 4-methylsulfonyloxy-2-(naphthalen-1-ylmethyl)-4-[[(4-nitrophenyl)methoxycarbonylamino]methyl]pyrrolidine-1-carboxylate

Systemtic Name: (4-nitrophenyl)methyl 4-methylsulfonyloxy-2-(naphthalen-1-ylmethyl)-4-[[(4-nitrophenyl)methoxycarbonylamino]methyl]pyrrolidine-1-carboxylate Openeye Name: (4-nitrophenyl)methyl 4-methylsulfonyloxy-2-(1-naphthylmethyl)-4-[[(4-nitrophenyl)methoxycarbonylamino]methyl]pyrrolidine-1-carboxylate CAS Name: 4-methylsulfonyloxy-2-(1-naphthalenylmethyl)-4-[[[(4-nitrophenyl)methoxy-oxomethyl]amino]methyl]-1-pyrrolidinecarboxylic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 4-methylsulfonyloxy-2-(naphthalen-1-ylmethyl)-4-[[(4-nitrophenyl)methoxycarbonylamino]methyl]pyrrolidine-1-carboxylate Traditional Name: 4-methylsulfonyloxy-2-(1-naphthylmethyl)-4-[[(4-nitrobenzyl)oxycarbonylamino]methyl]pyrrolidine-1-carboxylic acid (4-nitrobenzyl) ester Formula: C33H32N4O11S MolecularWeight: 692.69238

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OC1(CC(N(C1)C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])CC3=CC=CC4=CC=CC=C43)CNC(=O)OCC5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)OC1(CC(N(C1)C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])CC3=CC=CC4=CC=CC=C43)CNC(=O)OCC5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C33H32N4O11S/c1-49(44,45)48-33(21-34-31(38)46-19-23-9-13-27(14-10-23)36(40)41)18-29(17-26-7-4-6-25-5-2-3-8-30(25)26)35(22-33)32(39)47-20-24-11-15-28(16-12-24)37(42)43/h2-16,29H,17-22H2,1H3,(H,34,38)