2,3-dimethyl-1-(2-methylpropyl)benzo[f]benzimidazol-3-ium-4,9-dione iodide

Systemtic Name: 2,3-dimethyl-1-(2-methylpropyl)benzo[f]benzimidazol-3-ium-4,9-dione iodide Openeye Name: 1-isobutyl-2,3-dimethyl-benzo[f]benzimidazol-3-ium-4,9-dione iodide CAS Name: 2,3-dimethyl-1-(2-methylpropyl)benzo[f]benzimidazol-3-ium-4,9-dione iodide IUPAC Name: 2,3-dimethyl-1-(2-methylpropyl)benzo[f]benzimidazol-3-ium-4,9-dione iodide Traditional Name: 1-isobutyl-2,3-dimethyl-benzo[f]benzimidazol-3-ium-4,9-quinone iodide Formula: C17H19IN2O2 MolecularWeight: 410.24943

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C2=C(N1CC(C)C)C(=O)C3=CC=CC=C3C2=O)C.[I-]

Isomeric SMILES

CC1=[N+](C2=C(N1CC(C)C)C(=O)C3=CC=CC=C3C2=O)C.[I-]

InChI

InChI=1S/C17H19N2O2.HI/c1-10(2)9-19-11(3)18(4)14-15(19)17(21)13-8-6-5-7-12(13)16(14)20;/h5-8,10H,9H2,1-4H3;1H/q+1;/p-1