4,6-ditert-butyl-3-nitro-benzene-1,2-diol

Systemtic Name: 4,6-ditert-butyl-3-nitro-benzene-1,2-diol Openeye Name: 4,6-ditert-butyl-3-nitro-benzene-1,2-diol CAS Name: 4,6-ditert-butyl-3-nitrobenzene-1,2-diol IUPAC Name: 4,6-ditert-butyl-3-nitrobenzene-1,2-diol Traditional Name: 4,6-ditert-butyl-3-nitro-pyrocatechol Formula: C14H21NO4 MolecularWeight: 267.32084

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H21NO4/c1-13(2,3)8-7-9(14(4,5)6)11(16)12(17)10(8)15(18)19/h7,16-17H,1-6H3