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

Systemtic Name: 3-(4-nitro-2-oxidanyl-phenyl)propanoic acid Openeye Name: 3-(2-hydroxy-4-nitro-phenyl)propanoic acid CAS Name: 3-(2-hydroxy-4-nitrophenyl)propanoic acid IUPAC Name: 3-(2-hydroxy-4-nitrophenyl)propanoic acid Traditional Name: 3-(2-hydroxy-4-nitro-phenyl)propionic acid Formula: C9H9NO5 MolecularWeight: 211.17146

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H9NO5/c11-8-5-7(10(14)15)3-1-6(8)2-4-9(12)13/h1,3,5,11H,2,4H2,(H,12,13)