1-(4-bromophenyl)-4-[4-(2-nitrophenyl)piperazin-1-yl]butane-1,4-dione

Systemtic Name: 1-(4-bromophenyl)-4-[4-(2-nitrophenyl)piperazin-1-yl]butane-1,4-dione Openeye Name: 1-(4-bromophenyl)-4-[4-(2-nitrophenyl)piperazin-1-yl]butane-1,4-dione CAS Name: 1-(4-bromophenyl)-4-[4-(2-nitrophenyl)-1-piperazinyl]butane-1,4-dione IUPAC Name: 1-(4-bromophenyl)-4-[4-(2-nitrophenyl)piperazin-1-yl]butane-1,4-dione Traditional Name: 1-(4-bromophenyl)-4-[4-(2-nitrophenyl)piperazino]butane-1,4-dione Formula: C20H20BrN3O4 MolecularWeight: 446.2945

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H20BrN3O4/c21-16-7-5-15(6-8-16)19(25)9-10-20(26)23-13-11-22(12-14-23)17-3-1-2-4-18(17)24(27)28/h1-8H,9-14H2