dipropan-2-yl 5-(4-nitrophenoxy)carbonyloxy-6-oxidanyl-2,3-diazabicyclo[2.2.2]oct-7-ene-2,3-dicarboxylate

Systemtic Name: dipropan-2-yl 5-(4-nitrophenoxy)carbonyloxy-6-oxidanyl-2,3-diazabicyclo[2.2.2]oct-7-ene-2,3-dicarboxylate Openeye Name: diisopropyl 6-hydroxy-5-(4-nitrophenoxy)carbonyloxy-2,3-diazabicyclo[2.2.2]oct-7-ene-2,3-dicarboxylate CAS Name: 6-hydroxy-5-[(4-nitrophenoxy)-oxomethoxy]-2,3-diazabicyclo[2.2.2]oct-7-ene-2,3-dicarboxylic acid dipropan-2-yl ester IUPAC Name: dipropan-2-yl 6-hydroxy-5-(4-nitrophenoxy)carbonyloxy-2,3-diazabicyclo[2.2.2]oct-7-ene-2,3-dicarboxylate Traditional Name: 6-hydroxy-5-(4-nitrophenoxy)carbonyloxy-2,3-diazabicyclo[2.2.2]oct-7-ene-2,3-dicarboxylic acid diisopropyl ester Formula: C21H25N3O10 MolecularWeight: 479.4373

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)N1C2C=CC(N1C(=O)OC(C)C)C(C2O)OC(=O)OC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)OC(=O)N1C2C=CC(N1C(=O)OC(C)C)C(C2O)OC(=O)OC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H25N3O10/c1-11(2)31-19(26)22-15-9-10-16(23(22)20(27)32-12(3)4)18(17(15)25)34-21(28)33-14-7-5-13(6-8-14)24(29)30/h5-12,15-18,25H,1-4H3