6-(3,4-dinitrophenoxy)hexanoic acid

Systemtic Name: 6-(3,4-dinitrophenoxy)hexanoic acid Openeye Name: 6-(3,4-dinitrophenoxy)hexanoic acid CAS Name: 6-(3,4-dinitrophenoxy)hexanoic acid IUPAC Name: 6-(3,4-dinitrophenoxy)hexanoic acid Traditional Name: 6-(3,4-dinitrophenoxy)hexanoic acid Formula: C12H14N2O7 MolecularWeight: 298.24876

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1OCCCCCC(=O)O)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=C(C=C1OCCCCCC(=O)O)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C12H14N2O7/c15-12(16)4-2-1-3-7-21-9-5-6-10(13(17)18)11(8-9)14(19)20/h5-6,8H,1-4,7H2,(H,15,16)