4-[5-(3,4-dimethoxyphenyl)-1-(2-fluorophenyl)pyrazol-3-yl]benzenecarbonitrile

Systemtic Name: 4-[5-(3,4-dimethoxyphenyl)-1-(2-fluorophenyl)pyrazol-3-yl]benzenecarbonitrile Openeye Name: 4-[5-(3,4-dimethoxyphenyl)-1-(2-fluorophenyl)pyrazol-3-yl]benzonitrile CAS Name: 4-[5-(3,4-dimethoxyphenyl)-1-(2-fluorophenyl)-3-pyrazolyl]benzonitrile IUPAC Name: 4-[5-(3,4-dimethoxyphenyl)-1-(2-fluorophenyl)pyrazol-3-yl]benzonitrile Traditional Name: 4-[5-(3,4-dimethoxyphenyl)-1-(2-fluorophenyl)pyrazol-3-yl]benzonitrile Formula: C24H18FN3O2 MolecularWeight: 399.417023

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CC(=NN2C3=CC=CC=C3F)C4=CC=C(C=C4)C#N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CC(=NN2C3=CC=CC=C3F)C4=CC=C(C=C4)C#N)OC

InChI

InChI=1S/C24H18FN3O2/c1-29-23-12-11-18(13-24(23)30-2)22-14-20(17-9-7-16(15-26)8-10-17)27-28(22)21-6-4-3-5-19(21)25/h3-14H,1-2H3