3-[3,5-dimethyl-4-(2-oxidanylphenoxy)pyrazol-1-yl]propanenitrile

Systemtic Name: 3-[3,5-dimethyl-4-(2-oxidanylphenoxy)pyrazol-1-yl]propanenitrile Openeye Name: 3-[4-(2-hydroxyphenoxy)-3,5-dimethyl-pyrazol-1-yl]propanenitrile CAS Name: 3-[4-(2-hydroxyphenoxy)-3,5-dimethyl-1-pyrazolyl]propanenitrile IUPAC Name: 3-[4-(2-hydroxyphenoxy)-3,5-dimethylpyrazol-1-yl]propanenitrile Traditional Name: 3-[4-(2-hydroxyphenoxy)-3,5-dimethyl-pyrazol-1-yl]propionitrile Formula: C14H15N3O2 MolecularWeight: 257.2878

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CCC#N)C)OC2=CC=CC=C2O

Isomeric SMILES

CC1=C(C(=NN1CCC#N)C)OC2=CC=CC=C2O

InChI

InChI=1S/C14H15N3O2/c1-10-14(11(2)17(16-10)9-5-8-15)19-13-7-4-3-6-12(13)18/h3-4,6-7,18H,5,9H2,1-2H3