1-(3-bromophenyl)-4-[[5-(4-methoxy-2-nitro-phenyl)furan-2-yl]methylidene]pyrazolidine-3,5-dione

Systemtic Name: 1-(3-bromophenyl)-4-[[5-(4-methoxy-2-nitro-phenyl)furan-2-yl]methylidene]pyrazolidine-3,5-dione Openeye Name: 1-(3-bromophenyl)-4-[[5-(4-methoxy-2-nitro-phenyl)-2-furyl]methylene]pyrazolidine-3,5-dione CAS Name: 1-(3-bromophenyl)-4-[[5-(4-methoxy-2-nitrophenyl)-2-furanyl]methylidene]pyrazolidine-3,5-dione IUPAC Name: 1-(3-bromophenyl)-4-[[5-(4-methoxy-2-nitrophenyl)furan-2-yl]methylidene]pyrazolidine-3,5-dione Traditional Name: 1-(3-bromophenyl)-4-[[5-(4-methoxy-2-nitro-phenyl)-2-furyl]methylene]pyrazolidine-3,5-quinone Formula: C21H14BrN3O6 MolecularWeight: 484.25636

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C2=CC=C(O2)C=C3C(=O)NN(C3=O)C4=CC(=CC=C4)Br)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=C(C=C1)C2=CC=C(O2)C=C3C(=O)NN(C3=O)C4=CC(=CC=C4)Br)[N+](=O)[O-]

InChI

InChI=1S/C21H14BrN3O6/c1-30-14-5-7-16(18(11-14)25(28)29)19-8-6-15(31-19)10-17-20(26)23-24(21(17)27)13-4-2-3-12(22)9-13/h2-11H,1H3,(H,23,26)