4-[2,6-dinitro-3,4-bis(oxidanyl)phenyl]butanoic acid

Systemtic Name: 4-[2,6-dinitro-3,4-bis(oxidanyl)phenyl]butanoic acid Openeye Name: 4-(3,4-dihydroxy-2,6-dinitro-phenyl)butanoic acid CAS Name: 4-(3,4-dihydroxy-2,6-dinitrophenyl)butanoic acid IUPAC Name: 4-(3,4-dihydroxy-2,6-dinitrophenyl)butanoic acid Traditional Name: 4-(3,4-dihydroxy-2,6-dinitro-phenyl)butyric acid Formula: C10H10N2O8 MolecularWeight: 286.195

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=C(C(=C1O)O)[N+](=O)[O-])CCCC(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1=C(C(=C(C(=C1O)O)[N+](=O)[O-])CCCC(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C10H10N2O8/c13-7-4-6(11(17)18)5(2-1-3-8(14)15)9(10(7)16)12(19)20/h4,13,16H,1-3H2,(H,14,15)