1-(4-bromophenyl)-3-[4-(4-nitrophenyl)piperazin-1-yl]pyrrole-2,5-dione

Systemtic Name: 1-(4-bromophenyl)-3-[4-(4-nitrophenyl)piperazin-1-yl]pyrrole-2,5-dione Openeye Name: 1-(4-bromophenyl)-3-[4-(4-nitrophenyl)piperazin-1-yl]pyrrole-2,5-dione CAS Name: 1-(4-bromophenyl)-3-[4-(4-nitrophenyl)-1-piperazinyl]pyrrole-2,5-dione IUPAC Name: 1-(4-bromophenyl)-3-[4-(4-nitrophenyl)piperazin-1-yl]pyrrole-2,5-dione Traditional Name: 1-(4-bromophenyl)-3-[4-(4-nitrophenyl)piperazino]-3-pyrroline-2,5-quinone Formula: C20H17BrN4O4 MolecularWeight: 457.27738

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C3=CC(=O)N(C3=O)C4=CC=C(C=C4)Br

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C3=CC(=O)N(C3=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C20H17BrN4O4/c21-14-1-3-16(4-2-14)24-19(26)13-18(20(24)27)23-11-9-22(10-12-23)15-5-7-17(8-6-15)25(28)29/h1-8,13H,9-12H2