O3-[2-[(2,5-diphenylpyrazol-3-yl)amino]-2-oxidanylidene-ethyl] O1-methyl 5-nitrobenzene-1,3-dicarboxylate

Systemtic Name: O3-[2-[(2,5-diphenylpyrazol-3-yl)amino]-2-oxidanylidene-ethyl] O1-methyl 5-nitrobenzene-1,3-dicarboxylate Openeye Name: O3-[2-[(2,5-diphenylpyrazol-3-yl)amino]-2-oxo-ethyl] O1-methyl 5-nitrobenzene-1,3-dicarboxylate CAS Name: 5-nitrobenzene-1,3-dicarboxylic acid O3-[2-[(2,5-diphenyl-3-pyrazolyl)amino]-2-oxoethyl] ester O1-methyl ester IUPAC Name: 3-O-[2-[(2,5-diphenylpyrazol-3-yl)amino]-2-oxoethyl] 1-O-methyl 5-nitrobenzene-1,3-dicarboxylate Traditional Name: 5-nitrobenzene-1,3-dicarboxylic acid O3-[2-[(2,5-diphenylpyrazol-3-yl)amino]-2-keto-ethyl] ester O1-methyl ester Formula: C26H20N4O7 MolecularWeight: 500.4596

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)OCC(=O)NC2=CC(=NN2C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)OCC(=O)NC2=CC(=NN2C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C26H20N4O7/c1-36-25(32)18-12-19(14-21(13-18)30(34)35)26(33)37-16-24(31)27-23-15-22(17-8-4-2-5-9-17)28-29(23)20-10-6-3-7-11-20/h2-15H,16H2,1H3,(H,27,31)