2-bromanyl-3-(3-nitrophenyl)-3-oxidanyl-propanoic acid

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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