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

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-2-(propylamino)propanenitrile Openeye Name: 2-(1,3-benzodioxol-5-yl)-2-(propylamino)propanenitrile CAS Name: 2-(1,3-benzodioxol-5-yl)-2-(propylamino)propanenitrile IUPAC Name: 2-(1,3-benzodioxol-5-yl)-2-(propylamino)propanenitrile Traditional Name: 2-(1,3-benzodioxol-5-yl)-2-(propylamino)propionitrile Formula: C13H16N2O2 MolecularWeight: 232.27834

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(C)(C#N)C1=CC2=C(C=C1)OCO2

Isomeric SMILES

CCCNC(C)(C#N)C1=CC2=C(C=C1)OCO2

InChI

InChI=1S/C13H16N2O2/c1-3-6-15-13(2,8-14)10-4-5-11-12(7-10)17-9-16-11/h4-5,7,15H,3,6,9H2,1-2H3