ethyl 2-[(4Z)-4-[(2,4-dimethoxyphenyl)methylidene]-5-oxidanylidene-1-phenyl-pyrazol-3-yl]ethanoate

Systemtic Name: ethyl 2-[(4Z)-4-[(2,4-dimethoxyphenyl)methylidene]-5-oxidanylidene-1-phenyl-pyrazol-3-yl]ethanoate Openeye Name: ethyl 2-[(4Z)-4-[(2,4-dimethoxyphenyl)methylene]-5-oxo-1-phenyl-pyrazol-3-yl]acetate CAS Name: 2-[(4Z)-4-[(2,4-dimethoxyphenyl)methylidene]-5-oxo-1-phenyl-3-pyrazolyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[(4Z)-4-[(2,4-dimethoxyphenyl)methylidene]-5-oxo-1-phenylpyrazol-3-yl]acetate Traditional Name: 2-[(4Z)-4-(2,4-dimethoxybenzylidene)-5-keto-1-phenyl-2-pyrazolin-3-yl]acetic acid ethyl ester Formula: C22H22N2O5 MolecularWeight: 394.42048

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=NN(C(=O)C1=CC2=C(C=C(C=C2)OC)OC)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)CC\1=NN(C(=O)/C1=C\C2=C(C=C(C=C2)OC)OC)C3=CC=CC=C3

InChI

InChI=1S/C22H22N2O5/c1-4-29-21(25)14-19-18(12-15-10-11-17(27-2)13-20(15)28-3)22(26)24(23-19)16-8-6-5-7-9-16/h5-13H,4,14H2,1-3H3/b18-12-