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

Systemtic Name: (2S)-2-(1,3-benzodioxol-5-ylmethylamino)propanenitrile Openeye Name: (2S)-2-(1,3-benzodioxol-5-ylmethylamino)propanenitrile CAS Name: (2S)-2-(1,3-benzodioxol-5-ylmethylamino)propanenitrile IUPAC Name: (2S)-2-(1,3-benzodioxol-5-ylmethylamino)propanenitrile Traditional Name: (2S)-2-(piperonylamino)propionitrile Formula: C11H12N2O2 MolecularWeight: 204.22518

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C[C@@H](C#N)NCC1=CC2=C(C=C1)OCO2

InChI

InChI=1S/C11H12N2O2/c1-8(5-12)13-6-9-2-3-10-11(4-9)15-7-14-10/h2-4,8,13H,6-7H2,1H3/t8-/m0/s1