1-(2-oxidanylidenebenzimidazol-5-yl)butane-1,3-dione

Systemtic Name: 1-(2-oxidanylidenebenzimidazol-5-yl)butane-1,3-dione Openeye Name: 1-(2-oxobenzimidazol-5-yl)butane-1,3-dione CAS Name: 1-(2-oxo-5-benzimidazolyl)butane-1,3-dione IUPAC Name: 1-(2-oxobenzimidazol-5-yl)butane-1,3-dione Traditional Name: 1-(2-ketobenzimidazol-5-yl)butane-1,3-dione Formula: C11H8N2O3 MolecularWeight: 216.19282

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC(=O)C1=CC2=NC(=O)N=C2C=C1

Isomeric SMILES

CC(=O)CC(=O)C1=CC2=NC(=O)N=C2C=C1

InChI

InChI=1S/C11H8N2O3/c1-6(14)4-10(15)7-2-3-8-9(5-7)13-11(16)12-8/h2-3,5H,4H2,1H3