2-[1,3-bis(methoxycarbonylamino)propan-2-yloxycarbonylamino]ethyl (4-nitrophenyl) carbonate

Systemtic Name: 2-[1,3-bis(methoxycarbonylamino)propan-2-yloxycarbonylamino]ethyl (4-nitrophenyl) carbonate Openeye Name: 2-[[2-(methoxycarbonylamino)-1-[(methoxycarbonylamino)methyl]ethoxy]carbonylamino]ethyl (4-nitrophenyl) carbonate CAS Name: carbonic acid 2-[[1,3-bis(methoxycarbonylamino)propan-2-yloxy-oxomethyl]amino]ethyl (4-nitrophenyl) ester IUPAC Name: 2-[1,3-bis(methoxycarbonylamino)propan-2-yloxycarbonylamino]ethyl (4-nitrophenyl) carbonate Traditional Name: carbonic acid 2-[[2-(carbomethoxyamino)-1-[(carbomethoxyamino)methyl]ethoxy]carbonylamino]ethyl (4-nitrophenyl) ester Formula: C17H22N4O11 MolecularWeight: 458.37678

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)NCC(CNC(=O)OC)OC(=O)NCCOC(=O)OC1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

COC(=O)NCC(CNC(=O)OC)OC(=O)NCCOC(=O)OC1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C17H22N4O11/c1-28-14(22)19-9-13(10-20-15(23)29-2)31-16(24)18-7-8-30-17(25)32-12-5-3-11(4-6-12)21(26)27/h3-6,13H,7-10H2,1-2H3,(H,18,24)(H,19,22)(H,20,23)