2-[4-[2-(2-butan-2-ylphenoxy)ethanoyl]piperazin-1-yl]pyridine-4-carbonitrile

Systemtic Name: 2-[4-[2-(2-butan-2-ylphenoxy)ethanoyl]piperazin-1-yl]pyridine-4-carbonitrile Openeye Name: 2-[4-[2-(2-sec-butylphenoxy)acetyl]piperazin-1-yl]pyridine-4-carbonitrile CAS Name: 2-[4-[2-(2-butan-2-ylphenoxy)-1-oxoethyl]-1-piperazinyl]-4-pyridinecarbonitrile IUPAC Name: 2-[4-[2-(2-butan-2-ylphenoxy)acetyl]piperazin-1-yl]pyridine-4-carbonitrile Traditional Name: 2-[4-[2-(2-sec-butylphenoxy)acetyl]piperazino]isonicotinonitrile Formula: C22H26N4O2 MolecularWeight: 378.46744

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=CC=C1OCC(=O)N2CCN(CC2)C3=NC=CC(=C3)C#N

Isomeric SMILES

CCC(C)C1=CC=CC=C1OCC(=O)N2CCN(CC2)C3=NC=CC(=C3)C#N

InChI

InChI=1S/C22H26N4O2/c1-3-17(2)19-6-4-5-7-20(19)28-16-22(27)26-12-10-25(11-13-26)21-14-18(15-23)8-9-24-21/h4-9,14,17H,3,10-13,16H2,1-2H3