diethyl 1-(3-nitrophenyl)-5-phenyl-pyrazole-3,4-dicarboxylate

Systemtic Name: diethyl 1-(3-nitrophenyl)-5-phenyl-pyrazole-3,4-dicarboxylate Openeye Name: diethyl 1-(3-nitrophenyl)-5-phenyl-pyrazole-3,4-dicarboxylate CAS Name: 1-(3-nitrophenyl)-5-phenylpyrazole-3,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 1-(3-nitrophenyl)-5-phenylpyrazole-3,4-dicarboxylate Traditional Name: 1-(3-nitrophenyl)-5-phenyl-pyrazole-3,4-dicarboxylic acid diethyl ester Formula: C21H19N3O6 MolecularWeight: 409.39206

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1C(=O)OCC)C2=CC(=CC=C2)[N+](=O)[O-])C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1C(=O)OCC)C2=CC(=CC=C2)[N+](=O)[O-])C3=CC=CC=C3

InChI

InChI=1S/C21H19N3O6/c1-3-29-20(25)17-18(21(26)30-4-2)22-23(19(17)14-9-6-5-7-10-14)15-11-8-12-16(13-15)24(27)28/h5-13H,3-4H2,1-2H3