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

Systemtic Name: 2-[4-[5-nitro-6-(propan-2-ylamino)pyrimidin-4-yl]piperazin-1-yl]ethanol Openeye Name: 2-[4-[6-(isopropylamino)-5-nitro-pyrimidin-4-yl]piperazin-1-yl]ethanol CAS Name: 2-[4-[5-nitro-6-(propan-2-ylamino)-4-pyrimidinyl]-1-piperazinyl]ethanol IUPAC Name: 2-[4-[5-nitro-6-(propan-2-ylamino)pyrimidin-4-yl]piperazin-1-yl]ethanol Traditional Name: 2-[4-[6-(isopropylamino)-5-nitro-pyrimidin-4-yl]piperazino]ethanol Formula: C13H22N6O3 MolecularWeight: 310.35218

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC1=NC=NC(=C1[N+](=O)[O-])N2CCN(CC2)CCO

Isomeric SMILES

CC(C)NC1=NC=NC(=C1[N+](=O)[O-])N2CCN(CC2)CCO

InChI

InChI=1S/C13H22N6O3/c1-10(2)16-12-11(19(21)22)13(15-9-14-12)18-5-3-17(4-6-18)7-8-20/h9-10,20H,3-8H2,1-2H3,(H,14,15,16)