2-chloranyl-4-[3,5-diethyl-1-(2-hydroxyethyl)pyrazol-4-yl]oxy-benzenecarbonitrile

Systemtic Name: 2-chloranyl-4-[3,5-diethyl-1-(2-hydroxyethyl)pyrazol-4-yl]oxy-benzenecarbonitrile Openeye Name: 2-chloro-4-[3,5-diethyl-1-(2-hydroxyethyl)pyrazol-4-yl]oxy-benzonitrile CAS Name: 2-chloro-4-[[3,5-diethyl-1-(2-hydroxyethyl)-4-pyrazolyl]oxy]benzonitrile IUPAC Name: 2-chloro-4-[3,5-diethyl-1-(2-hydroxyethyl)pyrazol-4-yl]oxybenzonitrile Traditional Name: 2-chloro-4-[3,5-diethyl-1-(2-hydroxyethyl)pyrazol-4-yl]oxy-benzonitrile Formula: C16H18ClN3O2 MolecularWeight: 319.78602

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NN1CCO)CC)OC2=CC(=C(C=C2)C#N)Cl

Isomeric SMILES

CCC1=C(C(=NN1CCO)CC)OC2=CC(=C(C=C2)C#N)Cl

InChI

InChI=1S/C16H18ClN3O2/c1-3-14-16(15(4-2)20(19-14)7-8-21)22-12-6-5-11(10-18)13(17)9-12/h5-6,9,21H,3-4,7-8H2,1-2H3