5-tert-butyl-3-nitro-2-oxidanyl-benzoic acid

Systemtic Name: 5-tert-butyl-3-nitro-2-oxidanyl-benzoic acid Openeye Name: 5-tert-butyl-2-hydroxy-3-nitro-benzoic acid CAS Name: 5-tert-butyl-2-hydroxy-3-nitrobenzoic acid IUPAC Name: 5-tert-butyl-2-hydroxy-3-nitrobenzoic acid Traditional Name: 5-tert-butyl-2-hydroxy-3-nitro-benzoic acid Formula: C11H13NO5 MolecularWeight: 239.22462

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H13NO5/c1-11(2,3)6-4-7(10(14)15)9(13)8(5-6)12(16)17/h4-5,13H,1-3H3,(H,14,15)