(4Z)-1-(4-ethylphenyl)-4-[(5-methyl-3-oxidanylidene-2-phenyl-1H-pyrazol-4-yl)methylidene]pyrazolidine-3,5-dione

Systemtic Name: (4Z)-1-(4-ethylphenyl)-4-[(5-methyl-3-oxidanylidene-2-phenyl-1H-pyrazol-4-yl)methylidene]pyrazolidine-3,5-dione Openeye Name: (4Z)-1-(4-ethylphenyl)-4-[(5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)methylene]pyrazolidine-3,5-dione CAS Name: (4Z)-1-(4-ethylphenyl)-4-[(5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)methylidene]pyrazolidine-3,5-dione IUPAC Name: (4Z)-1-(4-ethylphenyl)-4-[(5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)methylidene]pyrazolidine-3,5-dione Traditional Name: (4Z)-1-(4-ethylphenyl)-4-[(5-keto-3-methyl-1-phenyl-3-pyrazolin-4-yl)methylene]pyrazolidine-3,5-quinone Formula: C22H20N4O3 MolecularWeight: 388.4192

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N2C(=O)C(=CC3=C(NN(C3=O)C4=CC=CC=C4)C)C(=O)N2

Isomeric SMILES

CCC1=CC=C(C=C1)N2C(=O)/C(=C\C3=C(NN(C3=O)C4=CC=CC=C4)C)/C(=O)N2

InChI

InChI=1S/C22H20N4O3/c1-3-15-9-11-17(12-10-15)26-22(29)19(20(27)24-26)13-18-14(2)23-25(21(18)28)16-7-5-4-6-8-16/h4-13,23H,3H2,1-2H3,(H,24,27)/b19-13-