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

Systemtic Name: (6-bromanylpyridin-3-yl)methyl-ethyl-[(E)-1-formamido-2-nitro-ethenyl]-methyl-azanium Openeye Name: (6-bromo-3-pyridyl)methyl-ethyl-[(E)-1-formamido-2-nitro-vinyl]-methyl-ammonium CAS Name: (6-bromo-3-pyridinyl)methyl-ethyl-[(E)-1-formamido-2-nitroethenyl]-methylammonium IUPAC Name: (6-bromopyridin-3-yl)methyl-ethyl-[(E)-1-formamido-2-nitroethenyl]-methylazanium Traditional Name: (6-bromo-3-pyridyl)methyl-ethyl-[(E)-1-formamido-2-nitro-vinyl]-methyl-ammonium Formula: C12H16BrN4O3+ MolecularWeight: 344.18444

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H15BrN4O3/c1-3-17(2,12(15-9-18)7-16(19)20)8-10-4-5-11(13)14-6-10/h4-7,9H,3,8H2,1-2H3/p+1/b12-7+