3-[(5-fluoranyl-2-nitro-phenyl)methyl-methyl-amino]propanenitrile

Systemtic Name: 3-[(5-fluoranyl-2-nitro-phenyl)methyl-methyl-amino]propanenitrile Openeye Name: 3-[(5-fluoro-2-nitro-phenyl)methyl-methyl-amino]propanenitrile CAS Name: 3-[(5-fluoro-2-nitrophenyl)methyl-methylamino]propanenitrile IUPAC Name: 3-[(5-fluoro-2-nitrophenyl)methyl-methylamino]propanenitrile Traditional Name: 3-[(5-fluoro-2-nitro-benzyl)-methyl-amino]propionitrile Formula: C11H12FN3O2 MolecularWeight: 237.230283

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CCC#N)CC1=C(C=CC(=C1)F)[N+](=O)[O-]

Isomeric SMILES

CN(CCC#N)CC1=C(C=CC(=C1)F)[N+](=O)[O-]

InChI

InChI=1S/C11H12FN3O2/c1-14(6-2-5-13)8-9-7-10(12)3-4-11(9)15(16)17/h3-4,7H,2,6,8H2,1H3