(1Z)-1-(2,6-ditert-butyl-4-methyl-phenoxy)-1-oxidanyl-3-oxidanylidene-hepta-1,6-diene-2-diazonium

Systemtic Name: (1Z)-1-(2,6-ditert-butyl-4-methyl-phenoxy)-1-oxidanyl-3-oxidanylidene-hepta-1,6-diene-2-diazonium Openeye Name: (1Z)-1-(2,6-ditert-butyl-4-methyl-phenoxy)-1-hydroxy-3-oxo-hepta-1,6-diene-2-diazonium CAS Name: (1Z)-1-(2,6-ditert-butyl-4-methylphenoxy)-1-hydroxy-3-oxo-2-hepta-1,6-dienediazonium IUPAC Name: (1Z)-1-(2,6-ditert-butyl-4-methylphenoxy)-1-hydroxy-3-oxohepta-1,6-diene-2-diazonium Traditional Name: (1Z)-1-(2,6-ditert-butyl-4-methyl-phenoxy)-1-hydroxy-3-keto-hepta-1,6-diene-2-diazonium Formula: C22H31N2O3+ MolecularWeight: 371.49314

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C(C)(C)C)OC(=C(C(=O)CCC=C)[N+]#N)O)C(C)(C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C(C)(C)C)O/C(=C(/C(=O)CCC=C)\[N+]#N)/O)C(C)(C)C

InChI

InChI=1S/C22H30N2O3/c1-9-10-11-17(25)18(24-23)20(26)27-19-15(21(3,4)5)12-14(2)13-16(19)22(6,7)8/h9,12-13H,1,10-11H2,2-8H3/p+1