ethyl 4-[(4E)-3-methylidene-4-[(5-methyl-3-oxidanylidene-2-phenyl-1H-pyrazol-4-yl)methylidene]-5-oxidanylidene-pyrazolidin-1-yl]benzoate

Systemtic Name: ethyl 4-[(4E)-3-methylidene-4-[(5-methyl-3-oxidanylidene-2-phenyl-1H-pyrazol-4-yl)methylidene]-5-oxidanylidene-pyrazolidin-1-yl]benzoate Openeye Name: ethyl 4-[(4E)-3-methylene-4-[(5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)methylene]-5-oxo-pyrazolidin-1-yl]benzoate CAS Name: 4-[(4E)-3-methylene-4-[(5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)methylidene]-5-oxo-1-pyrazolidinyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(4E)-3-methylidene-4-[(5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)methylidene]-5-oxopyrazolidin-1-yl]benzoate Traditional Name: 4-[(4E)-5-keto-4-[(5-keto-3-methyl-1-phenyl-3-pyrazolin-4-yl)methylene]-3-methylene-pyrazolidin-1-yl]benzoic acid ethyl ester Formula: C24H22N4O4 MolecularWeight: 430.45588

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)N2C(=O)C(=CC3=C(NN(C3=O)C4=CC=CC=C4)C)C(=C)N2

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N2C(=O)/C(=C/C3=C(NN(C3=O)C4=CC=CC=C4)C)/C(=C)N2

InChI

InChI=1S/C24H22N4O4/c1-4-32-24(31)17-10-12-19(13-11-17)28-23(30)21(16(3)26-28)14-20-15(2)25-27(22(20)29)18-8-6-5-7-9-18/h5-14,25-26H,3-4H2,1-2H3/b21-14+