(4-nitrophenyl)methyl N-[3-[(4-nitrophenyl)methoxycarbonylamino]-2-oxidanyl-propyl]carbamate

Systemtic Name: (4-nitrophenyl)methyl N-[3-[(4-nitrophenyl)methoxycarbonylamino]-2-oxidanyl-propyl]carbamate Openeye Name: (4-nitrophenyl)methyl N-[2-hydroxy-3-[(4-nitrophenyl)methoxycarbonylamino]propyl]carbamate CAS Name: N-[2-hydroxy-3-[[(4-nitrophenyl)methoxy-oxomethyl]amino]propyl]carbamic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl N-[2-hydroxy-3-[(4-nitrophenyl)methoxycarbonylamino]propyl]carbamate Traditional Name: N-[2-hydroxy-3-[(4-nitrobenzyl)oxycarbonylamino]propyl]carbamic acid (4-nitrobenzyl) ester Formula: C19H20N4O9 MolecularWeight: 448.3835

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1COC(=O)NCC(CNC(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])O)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1COC(=O)NCC(CNC(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])O)[N+](=O)[O-]

InChI

InChI=1S/C19H20N4O9/c24-17(9-20-18(25)31-11-13-1-5-15(6-2-13)22(27)28)10-21-19(26)32-12-14-3-7-16(8-4-14)23(29)30/h1-8,17,24H,9-12H2,(H,20,25)(H,21,26)