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

Systemtic Name: diethyl 2-[[3-(4-methoxy-3-nitro-phenyl)-1-phenyl-pyrazol-4-yl]methylidene]propanedioate Openeye Name: diethyl 2-[[3-(4-methoxy-3-nitro-phenyl)-1-phenyl-pyrazol-4-yl]methylene]propanedioate CAS Name: 2-[[3-(4-methoxy-3-nitrophenyl)-1-phenyl-4-pyrazolyl]methylidene]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[[3-(4-methoxy-3-nitrophenyl)-1-phenylpyrazol-4-yl]methylidene]propanedioate Traditional Name: 2-[[3-(4-methoxy-3-nitro-phenyl)-1-phenyl-pyrazol-4-yl]methylene]malonic acid diethyl ester Formula: C24H23N3O7 MolecularWeight: 465.45532

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H23N3O7/c1-4-33-23(28)19(24(29)34-5-2)13-17-15-26(18-9-7-6-8-10-18)25-22(17)16-11-12-21(32-3)20(14-16)27(30)31/h6-15H,4-5H2,1-3H3