3-acetyloxy-3,6-ditert-butyl-2,5,6-tris(oxidanyl)cyclohexa-1,4-diene-1,4-didiazonium

Systemtic Name: 3-acetyloxy-3,6-ditert-butyl-2,5,6-tris(oxidanyl)cyclohexa-1,4-diene-1,4-didiazonium Openeye Name: 3-acetoxy-3,6-ditert-butyl-2,5,6-trihydroxy-cyclohexa-1,4-diene-1,4-didiazonium CAS Name: 3-acetyloxy-3,6-ditert-butyl-2,5,6-trihydroxycyclohexa-1,4-diene-1,4-didiazonium IUPAC Name: 3-acetyloxy-3,6-ditert-butyl-2,5,6-trihydroxycyclohexa-1,4-diene-1,4-didiazonium Traditional Name: 3-acetoxy-3,6-ditert-butyl-2,5,6-trihydroxy-cyclohexa-1,4-diene-1,4-didiazonium Formula: C16H24N4O5+2 MolecularWeight: 352.38556

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1(C(=C(C(C(=C1O)[N+]#N)(C(C)(C)C)O)O)[N+]#N)C(C)(C)C

Isomeric SMILES

CC(=O)OC1(C(=C(C(C(=C1O)[N+]#N)(C(C)(C)C)O)O)[N+]#N)C(C)(C)C

InChI

InChI=1S/C16H22N4O5/c1-8(21)25-16(14(5,6)7)10(20-18)11(22)15(24,13(2,3)4)9(19-17)12(16)23/h24H,1-7H3/p+2