2-[(4-bromanyl-3-nitro-phenyl)methylamino]ethanoic acid

Systemtic Name: 2-[(4-bromanyl-3-nitro-phenyl)methylamino]ethanoic acid Openeye Name: 2-[(4-bromo-3-nitro-phenyl)methylamino]acetic acid CAS Name: 2-[(4-bromo-3-nitrophenyl)methylamino]acetic acid IUPAC Name: 2-[(4-bromo-3-nitrophenyl)methylamino]acetic acid Traditional Name: 2-[(4-bromo-3-nitro-benzyl)amino]acetic acid Formula: C9H9BrN2O4 MolecularWeight: 289.08276

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1CNCC(=O)O)[N+](=O)[O-])Br

Isomeric SMILES

C1=CC(=C(C=C1CNCC(=O)O)[N+](=O)[O-])Br

InChI

InChI=1S/C9H9BrN2O4/c10-7-2-1-6(3-8(7)12(15)16)4-11-5-9(13)14/h1-3,11H,4-5H2,(H,13,14)