1-(1-methylbenzimidazol-2-yl)octane-1,3-dione

Systemtic Name: 1-(1-methylbenzimidazol-2-yl)octane-1,3-dione Openeye Name: 1-(1-methylbenzimidazol-2-yl)octane-1,3-dione CAS Name: 1-(1-methyl-2-benzimidazolyl)octane-1,3-dione IUPAC Name: 1-(1-methylbenzimidazol-2-yl)octane-1,3-dione Traditional Name: 1-(1-methylbenzimidazol-2-yl)octane-1,3-dione Formula: C16H20N2O2 MolecularWeight: 272.3422

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)CC(=O)C1=NC2=CC=CC=C2N1C

Isomeric SMILES

CCCCCC(=O)CC(=O)C1=NC2=CC=CC=C2N1C

InChI

InChI=1S/C16H20N2O2/c1-3-4-5-8-12(19)11-15(20)16-17-13-9-6-7-10-14(13)18(16)2/h6-7,9-10H,3-5,8,11H2,1-2H3