[(E)-1-azanyl-2-nitro-ethenyl]-[(6-bromanylpyridin-3-yl)methyl]-(chloromethyl)-methyl-azanium

Systemtic Name: [(E)-1-azanyl-2-nitro-ethenyl]-[(6-bromanylpyridin-3-yl)methyl]-(chloromethyl)-methyl-azanium Openeye Name: [(E)-1-amino-2-nitro-vinyl]-[(6-bromo-3-pyridyl)methyl]-(chloromethyl)-methyl-ammonium CAS Name: [(E)-1-amino-2-nitroethenyl]-[(6-bromo-3-pyridinyl)methyl]-(chloromethyl)-methylammonium IUPAC Name: [(E)-1-amino-2-nitroethenyl]-[(6-bromopyridin-3-yl)methyl]-(chloromethyl)-methylazanium Traditional Name: [(E)-1-amino-2-nitro-vinyl]-[(6-bromo-3-pyridyl)methyl]-(chloromethyl)-methyl-ammonium Formula: C10H13BrClN4O2+ MolecularWeight: 336.59282

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[N+](CC1=CN=C(C=C1)Br)(CCl)C(=C[N+](=O)[O-])N

Isomeric SMILES

C[N+](CC1=CN=C(C=C1)Br)(CCl)/C(=C/[N+](=O)[O-])/N

InChI

InChI=1S/C10H13BrClN4O2/c1-16(7-12,10(13)5-15(17)18)6-8-2-3-9(11)14-4-8/h2-5H,6-7,13H2,1H3/q+1/b10-5+