2-(6-bromanyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-2-pyrrolidin-1-yl-ethanenitrile

Systemtic Name: 2-(6-bromanyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-2-pyrrolidin-1-yl-ethanenitrile Openeye Name: 2-(6-bromo-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-2-pyrrolidin-1-yl-acetonitrile CAS Name: 2-(6-bromo-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-2-(1-pyrrolidinyl)acetonitrile IUPAC Name: 2-(6-bromo-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-2-pyrrolidin-1-ylacetonitrile Traditional Name: 2-(6-bromo-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-2-pyrrolidino-acetonitrile Formula: C15H17BrN2O2 MolecularWeight: 337.21168

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(C#N)C2=CC3=C(C(=C2)Br)OCCCO3

Isomeric SMILES

C1CCN(C1)C(C#N)C2=CC3=C(C(=C2)Br)OCCCO3

InChI

InChI=1S/C15H17BrN2O2/c16-12-8-11(13(10-17)18-4-1-2-5-18)9-14-15(12)20-7-3-6-19-14/h8-9,13H,1-7H2