2-bromanyl-3-(3-nitro-4-oxidanyl-phenyl)propanoic acid

Systemtic Name: 2-bromanyl-3-(3-nitro-4-oxidanyl-phenyl)propanoic acid Openeye Name: 2-bromo-3-(4-hydroxy-3-nitro-phenyl)propanoic acid CAS Name: 2-bromo-3-(4-hydroxy-3-nitrophenyl)propanoic acid IUPAC Name: 2-bromo-3-(4-hydroxy-3-nitrophenyl)propanoic acid Traditional Name: 2-bromo-3-(4-hydroxy-3-nitro-phenyl)propionic acid Formula: C9H8BrNO5 MolecularWeight: 290.06752

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1CC(C(=O)O)Br)[N+](=O)[O-])O

Isomeric SMILES

C1=CC(=C(C=C1CC(C(=O)O)Br)[N+](=O)[O-])O

InChI

InChI=1S/C9H8BrNO5/c10-6(9(13)14)3-5-1-2-8(12)7(4-5)11(15)16/h1-2,4,6,12H,3H2,(H,13,14)