5-[[3-ethyl-5-(2-phenylmethoxyethyl)-1H-pyrazol-4-yl]oxy]benzene-1,3-dicarbonitrile

Systemtic Name: 5-[[3-ethyl-5-(2-phenylmethoxyethyl)-1H-pyrazol-4-yl]oxy]benzene-1,3-dicarbonitrile Openeye Name: 5-[[5-(2-benzyloxyethyl)-3-ethyl-1H-pyrazol-4-yl]oxy]benzene-1,3-dicarbonitrile CAS Name: 5-[[3-ethyl-5-(2-phenylmethoxyethyl)-1H-pyrazol-4-yl]oxy]benzene-1,3-dicarbonitrile IUPAC Name: 5-[[3-ethyl-5-(2-phenylmethoxyethyl)-1H-pyrazol-4-yl]oxy]benzene-1,3-dicarbonitrile Traditional Name: 5-[[5-(2-benzoxyethyl)-3-ethyl-1H-pyrazol-4-yl]oxy]isophthalonitrile Formula: C22H20N4O2 MolecularWeight: 372.4198

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NNC(=C1OC2=CC(=CC(=C2)C#N)C#N)CCOCC3=CC=CC=C3

Isomeric SMILES

CCC1=NNC(=C1OC2=CC(=CC(=C2)C#N)C#N)CCOCC3=CC=CC=C3

InChI

InChI=1S/C22H20N4O2/c1-2-20-22(28-19-11-17(13-23)10-18(12-19)14-24)21(26-25-20)8-9-27-15-16-6-4-3-5-7-16/h3-7,10-12H,2,8-9,15H2,1H3,(H,25,26)