2-(7-bromanyl-1,3-benzodioxol-5-yl)-2-piperidin-1-yl-ethanenitrile

Systemtic Name: 2-(7-bromanyl-1,3-benzodioxol-5-yl)-2-piperidin-1-yl-ethanenitrile Openeye Name: 2-(7-bromo-1,3-benzodioxol-5-yl)-2-(1-piperidyl)acetonitrile CAS Name: 2-(7-bromo-1,3-benzodioxol-5-yl)-2-(1-piperidinyl)acetonitrile IUPAC Name: 2-(7-bromo-1,3-benzodioxol-5-yl)-2-piperidin-1-ylacetonitrile Traditional Name: 2-(7-bromo-1,3-benzodioxol-5-yl)-2-piperidino-acetonitrile Formula: C14H15BrN2O2 MolecularWeight: 323.1851

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(C#N)C2=CC3=C(C(=C2)Br)OCO3

Isomeric SMILES

C1CCN(CC1)C(C#N)C2=CC3=C(C(=C2)Br)OCO3

InChI

InChI=1S/C14H15BrN2O2/c15-11-6-10(7-13-14(11)19-9-18-13)12(8-16)17-4-2-1-3-5-17/h6-7,12H,1-5,9H2