tert-butyl 5-nitro-2-oxidanyl-benzoate

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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