2-[4-[5-nitro-6-(4-pyridin-2-ylpiperazin-1-yl)pyrimidin-4-yl]piperazin-1-yl]phenol

Systemtic Name: 2-[4-[5-nitro-6-(4-pyridin-2-ylpiperazin-1-yl)pyrimidin-4-yl]piperazin-1-yl]phenol Openeye Name: 2-[4-[5-nitro-6-[4-(2-pyridyl)piperazin-1-yl]pyrimidin-4-yl]piperazin-1-yl]phenol CAS Name: 2-[4-[5-nitro-6-[4-(2-pyridinyl)-1-piperazinyl]-4-pyrimidinyl]-1-piperazinyl]phenol IUPAC Name: 2-[4-[5-nitro-6-(4-pyridin-2-ylpiperazin-1-yl)pyrimidin-4-yl]piperazin-1-yl]phenol Traditional Name: 2-[4-[5-nitro-6-[4-(2-pyridyl)piperazino]pyrimidin-4-yl]piperazino]phenol Formula: C23H26N8O3 MolecularWeight: 462.50434

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2O)C3=C(C(=NC=N3)N4CCN(CC4)C5=CC=CC=N5)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2O)C3=C(C(=NC=N3)N4CCN(CC4)C5=CC=CC=N5)[N+](=O)[O-]

InChI

InChI=1S/C23H26N8O3/c32-19-6-2-1-5-18(19)27-9-13-29(14-10-27)22-21(31(33)34)23(26-17-25-22)30-15-11-28(12-16-30)20-7-3-4-8-24-20/h1-8,17,32H,9-16H2