3-(1,3-benzodioxol-5-yl)-2-pyridin-3-yl-propanenitrile

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-2-pyridin-3-yl-propanenitrile Openeye Name: 3-(1,3-benzodioxol-5-yl)-2-(3-pyridyl)propanenitrile CAS Name: 3-(1,3-benzodioxol-5-yl)-2-(3-pyridinyl)propanenitrile IUPAC Name: 3-(1,3-benzodioxol-5-yl)-2-pyridin-3-ylpropanenitrile Traditional Name: 3-(1,3-benzodioxol-5-yl)-2-(3-pyridyl)propionitrile Formula: C15H12N2O2 MolecularWeight: 252.26798

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CC(C#N)C3=CN=CC=C3

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CC(C#N)C3=CN=CC=C3

InChI

InChI=1S/C15H12N2O2/c16-8-13(12-2-1-5-17-9-12)6-11-3-4-14-15(7-11)19-10-18-14/h1-5,7,9,13H,6,10H2