O3-[2-[1-adamantyl(furan-2-ylmethyl)amino]-2-oxidanylidene-ethyl] O1-methyl 5-nitrobenzene-1,3-dicarboxylate

Systemtic Name: O3-[2-[1-adamantyl(furan-2-ylmethyl)amino]-2-oxidanylidene-ethyl] O1-methyl 5-nitrobenzene-1,3-dicarboxylate Openeye Name: O3-[2-[1-adamantyl(2-furylmethyl)amino]-2-oxo-ethyl] O1-methyl 5-nitrobenzene-1,3-dicarboxylate CAS Name: 5-nitrobenzene-1,3-dicarboxylic acid O3-[2-[1-adamantyl(2-furanylmethyl)amino]-2-oxoethyl] ester O1-methyl ester IUPAC Name: 3-O-[2-[1-adamantyl(furan-2-ylmethyl)amino]-2-oxoethyl] 1-O-methyl 5-nitrobenzene-1,3-dicarboxylate Traditional Name: 5-nitrobenzene-1,3-dicarboxylic acid O3-[2-[1-adamantyl(2-furfuryl)amino]-2-keto-ethyl] ester O1-methyl ester Formula: C26H28N2O8 MolecularWeight: 496.50912

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)OCC(=O)N(CC2=CC=CO2)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)OCC(=O)N(CC2=CC=CO2)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C26H28N2O8/c1-34-24(30)19-8-20(10-21(9-19)28(32)33)25(31)36-15-23(29)27(14-22-3-2-4-35-22)26-11-16-5-17(12-26)7-18(6-16)13-26/h2-4,8-10,16-18H,5-7,11-15H2,1H3