2-bromanyl-2-(bromomethyl)pentanedinitrile; 2-bromanyl-2-nitro-propane-1,3-diol

Systemtic Name: 2-bromanyl-2-(bromomethyl)pentanedinitrile; 2-bromanyl-2-nitro-propane-1,3-diol Openeye Name: 2-bromo-2-(bromomethyl)pentanedinitrile; 2-bromo-2-nitro-propane-1,3-diol CAS Name: 2-bromo-2-(bromomethyl)pentanedinitrile; 2-bromo-2-nitropropane-1,3-diol IUPAC Name: 2-bromo-2-(bromomethyl)pentanedinitrile; 2-bromo-2-nitropropane-1,3-diol Traditional Name: 2-bromo-2-(bromomethyl)glutaronitrile; 2-bromo-2-nitro-propane-1,3-diol Formula: C9H12Br3N3O4 MolecularWeight: 465.92128

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Descriptors Computed from Structure

Canonical SMILES:

C(CC(CBr)(C#N)Br)C#N.C(C(CO)([N+](=O)[O-])Br)O

Isomeric SMILES

C(CC(CBr)(C#N)Br)C#N.C(C(CO)([N+](=O)[O-])Br)O

InChI

InChI=1S/C6H6Br2N2.C3H6BrNO4/c7-4-6(8,5-10)2-1-3-9;4-3(1-6,2-7)5(8)9/h1-2,4H2;6-7H,1-2H2