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

Systemtic Name: 2-[4-[5-nitro-6-(2-piperidin-1-ylethylamino)pyrimidin-4-yl]piperazin-1-yl]ethanol Openeye Name: 2-[4-[5-nitro-6-[2-(1-piperidyl)ethylamino]pyrimidin-4-yl]piperazin-1-yl]ethanol CAS Name: 2-[4-[5-nitro-6-[2-(1-piperidinyl)ethylamino]-4-pyrimidinyl]-1-piperazinyl]ethanol IUPAC Name: 2-[4-[5-nitro-6-(2-piperidin-1-ylethylamino)pyrimidin-4-yl]piperazin-1-yl]ethanol Traditional Name: 2-[4-[5-nitro-6-(2-piperidinoethylamino)pyrimidin-4-yl]piperazino]ethanol Formula: C17H29N7O3 MolecularWeight: 379.45726

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCNC2=NC=NC(=C2[N+](=O)[O-])N3CCN(CC3)CCO

Isomeric SMILES

C1CCN(CC1)CCNC2=NC=NC(=C2[N+](=O)[O-])N3CCN(CC3)CCO

InChI

InChI=1S/C17H29N7O3/c25-13-12-22-8-10-23(11-9-22)17-15(24(26)27)16(19-14-20-17)18-4-7-21-5-2-1-3-6-21/h14,25H,1-13H2,(H,18,19,20)