2-(1,3-benzodioxol-5-ylmethylamino)propanenitrile hydrochloride

Systemtic Name: 2-(1,3-benzodioxol-5-ylmethylamino)propanenitrile hydrochloride Openeye Name: 2-(1,3-benzodioxol-5-ylmethylamino)propanenitrile hydrochloride CAS Name: 2-(1,3-benzodioxol-5-ylmethylamino)propanenitrile hydrochloride IUPAC Name: 2-(1,3-benzodioxol-5-ylmethylamino)propanenitrile hydrochloride Traditional Name: 2-(piperonylamino)propionitrile hydrochloride Formula: C11H13ClN2O2 MolecularWeight: 240.68612

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)NCC1=CC2=C(C=C1)OCO2.Cl

Isomeric SMILES

CC(C#N)NCC1=CC2=C(C=C1)OCO2.Cl

InChI

InChI=1S/C11H12N2O2.ClH/c1-8(5-12)13-6-9-2-3-10-11(4-9)15-7-14-10;/h2-4,8,13H,6-7H2,1H3;1H