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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H26N4O2/c1-14(2)12-23-13-16(22)11-20-5-7-21(8-6-20)17-4-3-15(9-18)10-19-17/h3-4,10,14,16,22H,5-8,11-13H2,1-2H3