4-(1,3-benzodioxol-5-yl)-2-methyl-2-(methylamino)butanenitrile

Systemtic Name: 4-(1,3-benzodioxol-5-yl)-2-methyl-2-(methylamino)butanenitrile Openeye Name: 4-(1,3-benzodioxol-5-yl)-2-methyl-2-(methylamino)butanenitrile CAS Name: 4-(1,3-benzodioxol-5-yl)-2-methyl-2-(methylamino)butanenitrile IUPAC Name: 4-(1,3-benzodioxol-5-yl)-2-methyl-2-(methylamino)butanenitrile Traditional Name: 4-(1,3-benzodioxol-5-yl)-2-methyl-2-(methylamino)butyronitrile Formula: C13H16N2O2 MolecularWeight: 232.27834

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC2=C(C=C1)OCO2)(C#N)NC

Isomeric SMILES

CC(CCC1=CC2=C(C=C1)OCO2)(C#N)NC

InChI

InChI=1S/C13H16N2O2/c1-13(8-14,15-2)6-5-10-3-4-11-12(7-10)17-9-16-11/h3-4,7,15H,5-6,9H2,1-2H3