dimethyl 1-[4-nitro-2-(phenylcarbonyl)phenyl]pyrazole-3,5-dicarboxylate

Systemtic Name: dimethyl 1-[4-nitro-2-(phenylcarbonyl)phenyl]pyrazole-3,5-dicarboxylate Openeye Name: dimethyl 1-(2-benzoyl-4-nitro-phenyl)pyrazole-3,5-dicarboxylate CAS Name: 1-(2-benzoyl-4-nitrophenyl)pyrazole-3,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 1-(2-benzoyl-4-nitrophenyl)pyrazole-3,5-dicarboxylate Traditional Name: 1-(2-benzoyl-4-nitro-phenyl)pyrazole-3,5-dicarboxylic acid dimethyl ester Formula: C20H15N3O7 MolecularWeight: 409.349

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=NN1C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)C3=CC=CC=C3)C(=O)OC

Isomeric SMILES

COC(=O)C1=CC(=NN1C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)C3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C20H15N3O7/c1-29-19(25)15-11-17(20(26)30-2)22(21-15)16-9-8-13(23(27)28)10-14(16)18(24)12-6-4-3-5-7-12/h3-11H,1-2H3