1-[3-nitro-4-(4-pyrimidin-2-ylpiperazin-1-yl)phenyl]piperidine-2,6-dione

Systemtic Name: 1-[3-nitro-4-(4-pyrimidin-2-ylpiperazin-1-yl)phenyl]piperidine-2,6-dione Openeye Name: 1-[3-nitro-4-(4-pyrimidin-2-ylpiperazin-1-yl)phenyl]piperidine-2,6-dione CAS Name: 1-[3-nitro-4-[4-(2-pyrimidinyl)-1-piperazinyl]phenyl]piperidine-2,6-dione IUPAC Name: 1-[3-nitro-4-(4-pyrimidin-2-ylpiperazin-1-yl)phenyl]piperidine-2,6-dione Traditional Name: 1-[3-nitro-4-[4-(2-pyrimidyl)piperazino]phenyl]piperidine-2,6-quinone Formula: C19H20N6O4 MolecularWeight: 396.3999

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C(=O)C1)C2=CC(=C(C=C2)N3CCN(CC3)C4=NC=CC=N4)[N+](=O)[O-]

Isomeric SMILES

C1CC(=O)N(C(=O)C1)C2=CC(=C(C=C2)N3CCN(CC3)C4=NC=CC=N4)[N+](=O)[O-]

InChI

InChI=1S/C19H20N6O4/c26-17-3-1-4-18(27)24(17)14-5-6-15(16(13-14)25(28)29)22-9-11-23(12-10-22)19-20-7-2-8-21-19/h2,5-8,13H,1,3-4,9-12H2