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

Systemtic Name: 3-(3-nitro-4-oxidanyl-phenyl)-2-oxidanyl-propanoic acid Openeye Name: 2-hydroxy-3-(4-hydroxy-3-nitro-phenyl)propanoic acid CAS Name: 2-hydroxy-3-(4-hydroxy-3-nitrophenyl)propanoic acid IUPAC Name: 2-hydroxy-3-(4-hydroxy-3-nitrophenyl)propanoic acid Traditional Name: 2-hydroxy-3-(4-hydroxy-3-nitro-phenyl)propionic acid Formula: C9H9NO6 MolecularWeight: 227.17086

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H9NO6/c11-7-2-1-5(3-6(7)10(15)16)4-8(12)9(13)14/h1-3,8,11-12H,4H2,(H,13,14)