(4E)-1-(4-iodophenyl)-4-(1H-pyrazol-5-ylmethylidene)pyrazolidine-3,5-dione

Systemtic Name: (4E)-1-(4-iodophenyl)-4-(1H-pyrazol-5-ylmethylidene)pyrazolidine-3,5-dione Openeye Name: (4E)-1-(4-iodophenyl)-4-(1H-pyrazol-5-ylmethylene)pyrazolidine-3,5-dione CAS Name: (4E)-1-(4-iodophenyl)-4-(1H-pyrazol-5-ylmethylidene)pyrazolidine-3,5-dione IUPAC Name: (4E)-1-(4-iodophenyl)-4-(1H-pyrazol-5-ylmethylidene)pyrazolidine-3,5-dione Traditional Name: (4E)-1-(4-iodophenyl)-4-(1H-pyrazol-5-ylmethylene)pyrazolidine-3,5-quinone Formula: C13H9IN4O2 MolecularWeight: 380.14063

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1N2C(=O)C(=CC3=CC=NN3)C(=O)N2)I

Isomeric SMILES

C1=CC(=CC=C1N2C(=O)/C(=C/C3=CC=NN3)/C(=O)N2)I

InChI

InChI=1S/C13H9IN4O2/c14-8-1-3-10(4-2-8)18-13(20)11(12(19)17-18)7-9-5-6-15-16-9/h1-7H,(H,15,16)(H,17,19)/b11-7+