6-[4-[3-[(2-methylpropan-2-yl)oxy]-2-oxidanyl-propyl]piperazin-1-yl]pyridine-3-carbonitrile

Systemtic Name: 6-[4-[3-[(2-methylpropan-2-yl)oxy]-2-oxidanyl-propyl]piperazin-1-yl]pyridine-3-carbonitrile Openeye Name: 6-[4-(3-tert-butoxy-2-hydroxy-propyl)piperazin-1-yl]pyridine-3-carbonitrile CAS Name: 6-[4-[2-hydroxy-3-[(2-methylpropan-2-yl)oxy]propyl]-1-piperazinyl]-3-pyridinecarbonitrile IUPAC Name: 6-[4-[2-hydroxy-3-[(2-methylpropan-2-yl)oxy]propyl]piperazin-1-yl]pyridine-3-carbonitrile Traditional Name: 6-[4-(3-tert-butoxy-2-hydroxy-propyl)piperazino]nicotinonitrile Formula: C17H26N4O2 MolecularWeight: 318.41394

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OCC(CN1CCN(CC1)C2=NC=C(C=C2)C#N)O

Isomeric SMILES

CC(C)(C)OCC(CN1CCN(CC1)C2=NC=C(C=C2)C#N)O

InChI

InChI=1S/C17H26N4O2/c1-17(2,3)23-13-15(22)12-20-6-8-21(9-7-20)16-5-4-14(10-18)11-19-16/h4-5,11,15,22H,6-9,12-13H2,1-3H3