2-(6-bromanyl-1,3-benzodioxol-5-yl)-2-pyrrolidin-1-yl-ethanenitrile

Systemtic Name: 2-(6-bromanyl-1,3-benzodioxol-5-yl)-2-pyrrolidin-1-yl-ethanenitrile Openeye Name: 2-(6-bromo-1,3-benzodioxol-5-yl)-2-pyrrolidin-1-yl-acetonitrile CAS Name: 2-(6-bromo-1,3-benzodioxol-5-yl)-2-(1-pyrrolidinyl)acetonitrile IUPAC Name: 2-(6-bromo-1,3-benzodioxol-5-yl)-2-pyrrolidin-1-ylacetonitrile Traditional Name: 2-(6-bromo-1,3-benzodioxol-5-yl)-2-pyrrolidino-acetonitrile Formula: C13H13BrN2O2 MolecularWeight: 309.15852

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(C#N)C2=CC3=C(C=C2Br)OCO3

Isomeric SMILES

C1CCN(C1)C(C#N)C2=CC3=C(C=C2Br)OCO3

InChI

InChI=1S/C13H13BrN2O2/c14-10-6-13-12(17-8-18-13)5-9(10)11(7-15)16-3-1-2-4-16/h5-6,11H,1-4,8H2