5-[3,5-diethyl-1-[3-(oxan-2-yloxy)propyl]pyrazol-4-yl]oxybenzene-1,3-dicarbonitrile

Systemtic Name: 5-[3,5-diethyl-1-[3-(oxan-2-yloxy)propyl]pyrazol-4-yl]oxybenzene-1,3-dicarbonitrile Openeye Name: 5-[3,5-diethyl-1-(3-tetrahydropyran-2-yloxypropyl)pyrazol-4-yl]oxybenzene-1,3-dicarbonitrile CAS Name: 5-[[3,5-diethyl-1-[3-(2-oxanyloxy)propyl]-4-pyrazolyl]oxy]benzene-1,3-dicarbonitrile IUPAC Name: 5-[3,5-diethyl-1-[3-(oxan-2-yloxy)propyl]pyrazol-4-yl]oxybenzene-1,3-dicarbonitrile Traditional Name: 5-[3,5-diethyl-1-(3-tetrahydropyran-2-yloxypropyl)pyrazol-4-yl]oxyisophthalonitrile Formula: C23H28N4O3 MolecularWeight: 408.49342

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NN1CCCOC2CCCCO2)CC)OC3=CC(=CC(=C3)C#N)C#N

Isomeric SMILES

CCC1=C(C(=NN1CCCOC2CCCCO2)CC)OC3=CC(=CC(=C3)C#N)C#N

InChI

InChI=1S/C23H28N4O3/c1-3-20-23(30-19-13-17(15-24)12-18(14-19)16-25)21(4-2)27(26-20)9-7-11-29-22-8-5-6-10-28-22/h12-14,22H,3-11H2,1-2H3