6-(4-methoxy-2-nitro-5-oxidanyl-phenyl)hexanoic acid

Systemtic Name: 6-(4-methoxy-2-nitro-5-oxidanyl-phenyl)hexanoic acid Openeye Name: 6-(5-hydroxy-4-methoxy-2-nitro-phenyl)hexanoic acid CAS Name: 6-(5-hydroxy-4-methoxy-2-nitrophenyl)hexanoic acid IUPAC Name: 6-(5-hydroxy-4-methoxy-2-nitrophenyl)hexanoic acid Traditional Name: 6-(5-hydroxy-4-methoxy-2-nitro-phenyl)hexanoic acid Formula: C13H17NO6 MolecularWeight: 283.27718

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17NO6/c1-20-12-8-10(14(18)19)9(7-11(12)15)5-3-2-4-6-13(16)17/h7-8,15H,2-6H2,1H3,(H,16,17)