2-[4-[5-nitro-6-(4-phenylpiperazin-1-yl)pyrimidin-4-yl]piperazin-1-yl]ethanol

Systemtic Name: 2-[4-[5-nitro-6-(4-phenylpiperazin-1-yl)pyrimidin-4-yl]piperazin-1-yl]ethanol Openeye Name: 2-[4-[5-nitro-6-(4-phenylpiperazin-1-yl)pyrimidin-4-yl]piperazin-1-yl]ethanol CAS Name: 2-[4-[5-nitro-6-(4-phenyl-1-piperazinyl)-4-pyrimidinyl]-1-piperazinyl]ethanol IUPAC Name: 2-[4-[5-nitro-6-(4-phenylpiperazin-1-yl)pyrimidin-4-yl]piperazin-1-yl]ethanol Traditional Name: 2-[4-[5-nitro-6-(4-phenylpiperazino)pyrimidin-4-yl]piperazino]ethanol Formula: C20H27N7O3 MolecularWeight: 413.47348

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCO)C2=NC=NC(=C2[N+](=O)[O-])N3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1CCO)C2=NC=NC(=C2[N+](=O)[O-])N3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C20H27N7O3/c28-15-14-23-6-8-25(9-7-23)19-18(27(29)30)20(22-16-21-19)26-12-10-24(11-13-26)17-4-2-1-3-5-17/h1-5,16,28H,6-15H2