diethyl 2-[[3-(3-nitrophenyl)-1-phenyl-pyrazol-4-yl]methylidene]propanedioate

Systemtic Name: diethyl 2-[[3-(3-nitrophenyl)-1-phenyl-pyrazol-4-yl]methylidene]propanedioate Openeye Name: diethyl 2-[[3-(3-nitrophenyl)-1-phenyl-pyrazol-4-yl]methylene]propanedioate CAS Name: 2-[[3-(3-nitrophenyl)-1-phenyl-4-pyrazolyl]methylidene]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[[3-(3-nitrophenyl)-1-phenylpyrazol-4-yl]methylidene]propanedioate Traditional Name: 2-[[3-(3-nitrophenyl)-1-phenyl-pyrazol-4-yl]methylene]malonic acid diethyl ester Formula: C23H21N3O6 MolecularWeight: 435.42934

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CC1=CN(N=C1C2=CC(=CC=C2)[N+](=O)[O-])C3=CC=CC=C3)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(=CC1=CN(N=C1C2=CC(=CC=C2)[N+](=O)[O-])C3=CC=CC=C3)C(=O)OCC

InChI

InChI=1S/C23H21N3O6/c1-3-31-22(27)20(23(28)32-4-2)14-17-15-25(18-10-6-5-7-11-18)24-21(17)16-9-8-12-19(13-16)26(29)30/h5-15H,3-4H2,1-2H3