4-(4-methoxy-2-nitro-5-oxidanyl-phenyl)butanoic acid

Systemtic Name: 4-(4-methoxy-2-nitro-5-oxidanyl-phenyl)butanoic acid Openeye Name: 4-(5-hydroxy-4-methoxy-2-nitro-phenyl)butanoic acid CAS Name: 4-(5-hydroxy-4-methoxy-2-nitrophenyl)butanoic acid IUPAC Name: 4-(5-hydroxy-4-methoxy-2-nitrophenyl)butanoic acid Traditional Name: 4-(5-hydroxy-4-methoxy-2-nitro-phenyl)butyric acid Formula: C11H13NO6 MolecularWeight: 255.22402

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)[N+](=O)[O-])CCCC(=O)O)O

Isomeric SMILES

COC1=C(C=C(C(=C1)[N+](=O)[O-])CCCC(=O)O)O

InChI

InChI=1S/C11H13NO6/c1-18-10-6-8(12(16)17)7(5-9(10)13)3-2-4-11(14)15/h5-6,13H,2-4H2,1H3,(H,14,15)