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

Systemtic Name: 4-[5-(1,3-benzodioxol-5-yl)-1-pyridin-2-yl-pyrazol-3-yl]benzenecarbonitrile Openeye Name: 4-[5-(1,3-benzodioxol-5-yl)-1-(2-pyridyl)pyrazol-3-yl]benzonitrile CAS Name: 4-[5-(1,3-benzodioxol-5-yl)-1-(2-pyridinyl)-3-pyrazolyl]benzonitrile IUPAC Name: 4-[5-(1,3-benzodioxol-5-yl)-1-pyridin-2-ylpyrazol-3-yl]benzonitrile Traditional Name: 4-[5-(1,3-benzodioxol-5-yl)-1-(2-pyridyl)pyrazol-3-yl]benzonitrile Formula: C22H14N4O2 MolecularWeight: 366.37216

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C3=CC(=NN3C4=CC=CC=N4)C5=CC=C(C=C5)C#N

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C3=CC(=NN3C4=CC=CC=N4)C5=CC=C(C=C5)C#N

InChI

InChI=1S/C22H14N4O2/c23-13-15-4-6-16(7-5-15)18-12-19(26(25-18)22-3-1-2-10-24-22)17-8-9-20-21(11-17)28-14-27-20/h1-12H,14H2