6-butan-2-ylimidazo[1,5-c]imidazol-6-ium-5-one

Systemtic Name: 6-butan-2-ylimidazo[1,5-c]imidazol-6-ium-5-one Openeye Name: 6-sec-butylimidazo[1,5-c]imidazol-6-ium-5-one CAS Name: 6-butan-2-yl-5-imidazo[1,5-c]imidazol-6-iumone IUPAC Name: 6-butan-2-ylimidazo[1,5-c]imidazol-6-ium-5-one Traditional Name: 6-sec-butylimidaz[1,5-c]imidazol-6-ium-5-one Formula: C9H12N3O+ MolecularWeight: 178.21108

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)[N+]1=CC2=CN=CN2C1=O

Isomeric SMILES

CCC(C)[N+]1=CC2=CN=CN2C1=O

InChI

InChI=1S/C9H12N3O/c1-3-7(2)11-5-8-4-10-6-12(8)9(11)13/h4-7H,3H2,1-2H3/q+1