2-[(4-bromanyl-3-nitro-phenyl)carbonyl-methyl-amino]ethanoic acid

Systemtic Name: 2-[(4-bromanyl-3-nitro-phenyl)carbonyl-methyl-amino]ethanoic acid Openeye Name: 2-[(4-bromo-3-nitro-benzoyl)-methyl-amino]acetic acid CAS Name: 2-[[(4-bromo-3-nitrophenyl)-oxomethyl]-methylamino]acetic acid IUPAC Name: 2-[(4-bromo-3-nitrobenzoyl)-methylamino]acetic acid Traditional Name: 2-[(4-bromo-3-nitro-benzoyl)-methyl-amino]acetic acid Formula: C10H9BrN2O5 MolecularWeight: 317.09286

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H9BrN2O5/c1-12(5-9(14)15)10(16)6-2-3-7(11)8(4-6)13(17)18/h2-4H,5H2,1H3,(H,14,15)