(4-nitrophenyl)methyl 4-[3-methyl-1-[(4-nitrophenyl)methoxycarbonyl]pyrrolidin-2-yl]carbonylpiperazine-1-carboxylate

Systemtic Name: (4-nitrophenyl)methyl 4-[3-methyl-1-[(4-nitrophenyl)methoxycarbonyl]pyrrolidin-2-yl]carbonylpiperazine-1-carboxylate Openeye Name: (4-nitrophenyl)methyl 4-[3-methyl-1-[(4-nitrophenyl)methoxycarbonyl]pyrrolidine-2-carbonyl]piperazine-1-carboxylate CAS Name: 4-[[3-methyl-1-[(4-nitrophenyl)methoxy-oxomethyl]-2-pyrrolidinyl]-oxomethyl]-1-piperazinecarboxylic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 4-[3-methyl-1-[(4-nitrophenyl)methoxycarbonyl]pyrrolidine-2-carbonyl]piperazine-1-carboxylate Traditional Name: 4-[3-methyl-1-(4-nitrobenzyl)oxycarbonyl-prolyl]piperazine-1-carboxylic acid (4-nitrobenzyl) ester Formula: C26H29N5O9 MolecularWeight: 555.53656

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(C1C(=O)N2CCN(CC2)C(=O)OCC3=CC=C(C=C3)[N+](=O)[O-])C(=O)OCC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC1CCN(C1C(=O)N2CCN(CC2)C(=O)OCC3=CC=C(C=C3)[N+](=O)[O-])C(=O)OCC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C26H29N5O9/c1-18-10-11-29(26(34)40-17-20-4-8-22(9-5-20)31(37)38)23(18)24(32)27-12-14-28(15-13-27)25(33)39-16-19-2-6-21(7-3-19)30(35)36/h2-9,18,23H,10-17H2,1H3