4-[3-cyclopropyl-1-ethyl-5-(hydroxymethyl)pyrazol-4-yl]oxy-2,6-dimethyl-benzenecarbonitrile

Systemtic Name: 4-[3-cyclopropyl-1-ethyl-5-(hydroxymethyl)pyrazol-4-yl]oxy-2,6-dimethyl-benzenecarbonitrile Openeye Name: 4-[3-cyclopropyl-1-ethyl-5-(hydroxymethyl)pyrazol-4-yl]oxy-2,6-dimethyl-benzonitrile CAS Name: 4-[[3-cyclopropyl-1-ethyl-5-(hydroxymethyl)-4-pyrazolyl]oxy]-2,6-dimethylbenzonitrile IUPAC Name: 4-[3-cyclopropyl-1-ethyl-5-(hydroxymethyl)pyrazol-4-yl]oxy-2,6-dimethylbenzonitrile Traditional Name: 4-(3-cyclopropyl-1-ethyl-5-methylol-pyrazol-4-yl)oxy-2,6-dimethyl-benzonitrile Formula: C18H21N3O2 MolecularWeight: 311.37824

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(=N1)C2CC2)OC3=CC(=C(C(=C3)C)C#N)C)CO

Isomeric SMILES

CCN1C(=C(C(=N1)C2CC2)OC3=CC(=C(C(=C3)C)C#N)C)CO

InChI

InChI=1S/C18H21N3O2/c1-4-21-16(10-22)18(17(20-21)13-5-6-13)23-14-7-11(2)15(9-19)12(3)8-14/h7-8,13,22H,4-6,10H2,1-3H3