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

Systemtic Name: 2-[4-[6-(azepan-1-yl)-5-nitro-pyrimidin-4-yl]piperazin-1-yl]ethanol Openeye Name: 2-[4-[6-(azepan-1-yl)-5-nitro-pyrimidin-4-yl]piperazin-1-yl]ethanol CAS Name: 2-[4-[6-(1-azepanyl)-5-nitro-4-pyrimidinyl]-1-piperazinyl]ethanol IUPAC Name: 2-[4-[6-(azepan-1-yl)-5-nitropyrimidin-4-yl]piperazin-1-yl]ethanol Traditional Name: 2-[4-[6-(azepan-1-yl)-5-nitro-pyrimidin-4-yl]piperazino]ethanol Formula: C16H26N6O3 MolecularWeight: 350.41604

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=C(C(=NC=N2)N3CCN(CC3)CCO)[N+](=O)[O-]

Isomeric SMILES

C1CCCN(CC1)C2=C(C(=NC=N2)N3CCN(CC3)CCO)[N+](=O)[O-]

InChI

InChI=1S/C16H26N6O3/c23-12-11-19-7-9-21(10-8-19)16-14(22(24)25)15(17-13-18-16)20-5-3-1-2-4-6-20/h13,23H,1-12H2