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

Systemtic Name: diethyl 2-[[3-(3,4-dimethoxyphenyl)-1-phenyl-pyrazol-4-yl]methylidene]propanedioate Openeye Name: diethyl 2-[[3-(3,4-dimethoxyphenyl)-1-phenyl-pyrazol-4-yl]methylene]propanedioate CAS Name: 2-[[3-(3,4-dimethoxyphenyl)-1-phenyl-4-pyrazolyl]methylidene]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[[3-(3,4-dimethoxyphenyl)-1-phenylpyrazol-4-yl]methylidene]propanedioate Traditional Name: 2-[[3-(3,4-dimethoxyphenyl)-1-phenyl-pyrazol-4-yl]methylene]malonic acid diethyl ester Formula: C25H26N2O6 MolecularWeight: 450.48374

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CC1=CN(N=C1C2=CC(=C(C=C2)OC)OC)C3=CC=CC=C3)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(=CC1=CN(N=C1C2=CC(=C(C=C2)OC)OC)C3=CC=CC=C3)C(=O)OCC

InChI

InChI=1S/C25H26N2O6/c1-5-32-24(28)20(25(29)33-6-2)14-18-16-27(19-10-8-7-9-11-19)26-23(18)17-12-13-21(30-3)22(15-17)31-4/h7-16H,5-6H2,1-4H3