4-tert-butyl-4-oxidanyl-1H-[1,2,3]oxadiazolo[3,4-a]indol-9-ium-3-one

Systemtic Name: 4-tert-butyl-4-oxidanyl-1H-[1,2,3]oxadiazolo[3,4-a]indol-9-ium-3-one Openeye Name: 4-tert-butyl-4-hydroxy-1H-oxadiazolo[3,4-a]indol-9-ium-3-one CAS Name: 4-tert-butyl-4-hydroxy-1H-oxadiazolo[3,4-a]indol-9-ium-3-one IUPAC Name: 4-tert-butyl-4-hydroxy-1H-oxadiazolo[3,4-a]indol-9-ium-3-one Traditional Name: 4-tert-butyl-4-hydroxy-1H-oxadiazol[3,4-a]indol-9-ium-3-one Formula: C13H15N2O3+ MolecularWeight: 247.2698

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1(C2=CC=CC=C2[N+]3=C1C(=O)ON3)O

Isomeric SMILES

CC(C)(C)C1(C2=CC=CC=C2[N+]3=C1C(=O)ON3)O

InChI

InChI=1S/C13H14N2O3/c1-12(2,3)13(17)8-6-4-5-7-9(8)15-10(13)11(16)18-14-15/h4-7,17H,1-3H3/p+1