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

Systemtic Name: (4E)-1-(4-bromophenyl)-4-[(5-methyl-3-oxidanylidene-2-phenyl-1H-pyrazol-4-yl)methylidene]pyrazolidine-3,5-dione Openeye Name: (4E)-1-(4-bromophenyl)-4-[(5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)methylene]pyrazolidine-3,5-dione CAS Name: (4E)-1-(4-bromophenyl)-4-[(5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)methylidene]pyrazolidine-3,5-dione IUPAC Name: (4E)-1-(4-bromophenyl)-4-[(5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)methylidene]pyrazolidine-3,5-dione Traditional Name: (4E)-1-(4-bromophenyl)-4-[(5-keto-3-methyl-1-phenyl-3-pyrazolin-4-yl)methylene]pyrazolidine-3,5-quinone Formula: C20H15BrN4O3 MolecularWeight: 439.2621

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1)C2=CC=CC=C2)C=C3C(=O)NN(C3=O)C4=CC=C(C=C4)Br

Isomeric SMILES

CC1=C(C(=O)N(N1)C2=CC=CC=C2)/C=C/3\C(=O)NN(C3=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C20H15BrN4O3/c1-12-16(19(27)24(22-12)14-5-3-2-4-6-14)11-17-18(26)23-25(20(17)28)15-9-7-13(21)8-10-15/h2-11,22H,1H3,(H,23,26)/b17-11+