(4E)-1-(3-bromophenyl)-4-[(5-nitrofuran-2-yl)methylidene]pyrazolidine-3,5-dione

Systemtic Name: (4E)-1-(3-bromophenyl)-4-[(5-nitrofuran-2-yl)methylidene]pyrazolidine-3,5-dione Openeye Name: (4E)-1-(3-bromophenyl)-4-[(5-nitro-2-furyl)methylene]pyrazolidine-3,5-dione CAS Name: (4E)-1-(3-bromophenyl)-4-[(5-nitro-2-furanyl)methylidene]pyrazolidine-3,5-dione IUPAC Name: (4E)-1-(3-bromophenyl)-4-[(5-nitrofuran-2-yl)methylidene]pyrazolidine-3,5-dione Traditional Name: (4E)-1-(3-bromophenyl)-4-[(5-nitro-2-furyl)methylene]pyrazolidine-3,5-quinone Formula: C14H8BrN3O5 MolecularWeight: 378.13442

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)N2C(=O)C(=CC3=CC=C(O3)[N+](=O)[O-])C(=O)N2

Isomeric SMILES

C1=CC(=CC(=C1)Br)N2C(=O)/C(=C/C3=CC=C(O3)[N+](=O)[O-])/C(=O)N2

InChI

InChI=1S/C14H8BrN3O5/c15-8-2-1-3-9(6-8)17-14(20)11(13(19)16-17)7-10-4-5-12(23-10)18(21)22/h1-7H,(H,16,19)/b11-7+