4-[(2-fluoranylphenoxy)methyl]-2-[(2-methylpropan-2-yl)oxy]-1-(pyrazin-2-ylmethyl)piperidine-4-carbonitrile

Systemtic Name: 4-[(2-fluoranylphenoxy)methyl]-2-[(2-methylpropan-2-yl)oxy]-1-(pyrazin-2-ylmethyl)piperidine-4-carbonitrile Openeye Name: 2-tert-butoxy-4-[(2-fluorophenoxy)methyl]-1-(pyrazin-2-ylmethyl)piperidine-4-carbonitrile CAS Name: 4-[(2-fluorophenoxy)methyl]-2-[(2-methylpropan-2-yl)oxy]-1-(2-pyrazinylmethyl)-4-piperidinecarbonitrile IUPAC Name: 4-[(2-fluorophenoxy)methyl]-2-[(2-methylpropan-2-yl)oxy]-1-(pyrazin-2-ylmethyl)piperidine-4-carbonitrile Traditional Name: 2-tert-butoxy-4-[(2-fluorophenoxy)methyl]-1-(pyrazin-2-ylmethyl)isonipecotonitrile Formula: C22H27FN4O2 MolecularWeight: 398.473783

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC1CC(CCN1CC2=NC=CN=C2)(COC3=CC=CC=C3F)C#N

Isomeric SMILES

CC(C)(C)OC1CC(CCN1CC2=NC=CN=C2)(COC3=CC=CC=C3F)C#N

InChI

InChI=1S/C22H27FN4O2/c1-21(2,3)29-20-12-22(15-24,16-28-19-7-5-4-6-18(19)23)8-11-27(20)14-17-13-25-9-10-26-17/h4-7,9-10,13,20H,8,11-12,14,16H2,1-3H3