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

Systemtic Name: 4-[1-(1,3-benzodioxol-5-yl)-5-(2-fluorophenyl)pyrazol-3-yl]benzenecarbonitrile Openeye Name: 4-[1-(1,3-benzodioxol-5-yl)-5-(2-fluorophenyl)pyrazol-3-yl]benzonitrile CAS Name: 4-[1-(1,3-benzodioxol-5-yl)-5-(2-fluorophenyl)-3-pyrazolyl]benzonitrile IUPAC Name: 4-[1-(1,3-benzodioxol-5-yl)-5-(2-fluorophenyl)pyrazol-3-yl]benzonitrile Traditional Name: 4-[1-(1,3-benzodioxol-5-yl)-5-(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)N3C(=CC(=N3)C4=CC=C(C=C4)C#N)C5=CC=CC=C5F

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)N3C(=CC(=N3)C4=CC=C(C=C4)C#N)C5=CC=CC=C5F

InChI

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