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

Systemtic Name: 4-[5-(1,3-benzodioxol-5-yl)-1-(2-fluorophenyl)pyrazol-3-yl]benzenecarbonitrile Openeye Name: 4-[5-(1,3-benzodioxol-5-yl)-1-(2-fluorophenyl)pyrazol-3-yl]benzonitrile CAS Name: 4-[5-(1,3-benzodioxol-5-yl)-1-(2-fluorophenyl)-3-pyrazolyl]benzonitrile IUPAC Name: 4-[5-(1,3-benzodioxol-5-yl)-1-(2-fluorophenyl)pyrazol-3-yl]benzonitrile Traditional Name: 4-[5-(1,3-benzodioxol-5-yl)-1-(2-fluorophenyl)pyrazol-3-yl]benzonitrile Formula: C23H14FN3O2 MolecularWeight: 383.374563

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C3=CC(=NN3C4=CC=CC=C4F)C5=CC=C(C=C5)C#N

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C3=CC(=NN3C4=CC=CC=C4F)C5=CC=C(C=C5)C#N

InChI

InChI=1S/C23H14FN3O2/c24-18-3-1-2-4-20(18)27-21(17-9-10-22-23(11-17)29-14-28-22)12-19(26-27)16-7-5-15(13-25)6-8-16/h1-12H,14H2