3-[[5-(dimethylamino)-4-nitro-2,1,3-benzoxadiazol-7-yl]-methyl-amino]propanenitrile

Systemtic Name: 3-[[5-(dimethylamino)-4-nitro-2,1,3-benzoxadiazol-7-yl]-methyl-amino]propanenitrile Openeye Name: 3-[[5-(dimethylamino)-4-nitro-2,1,3-benzoxadiazol-7-yl]-methyl-amino]propanenitrile CAS Name: 3-[[5-(dimethylamino)-4-nitro-2,1,3-benzoxadiazol-7-yl]-methylamino]propanenitrile IUPAC Name: 3-[[5-(dimethylamino)-4-nitro-2,1,3-benzoxadiazol-7-yl]-methylamino]propanenitrile Traditional Name: 3-[[6-(dimethylamino)-7-nitro-benzofurazan-4-yl]-methyl-amino]propionitrile Formula: C12H14N6O3 MolecularWeight: 290.27796

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=C(C2=NON=C2C(=C1)N(C)CCC#N)[N+](=O)[O-]

Isomeric SMILES

CN(C)C1=C(C2=NON=C2C(=C1)N(C)CCC#N)[N+](=O)[O-]

InChI

InChI=1S/C12H14N6O3/c1-16(2)9-7-8(17(3)6-4-5-13)10-11(15-21-14-10)12(9)18(19)20/h7H,4,6H2,1-3H3