2,3-dimethyl-1-propan-2-yl-benzo[f]benzimidazol-3-ium-4,9-dione iodide

Systemtic Name: 2,3-dimethyl-1-propan-2-yl-benzo[f]benzimidazol-3-ium-4,9-dione iodide Openeye Name: 1-isopropyl-2,3-dimethyl-benzo[f]benzimidazol-3-ium-4,9-dione iodide CAS Name: 2,3-dimethyl-1-propan-2-ylbenzo[f]benzimidazol-3-ium-4,9-dione iodide IUPAC Name: 2,3-dimethyl-1-propan-2-ylbenzo[f]benzimidazol-3-ium-4,9-dione iodide Traditional Name: 1-isopropyl-2,3-dimethyl-benzo[f]benzimidazol-3-ium-4,9-quinone iodide Formula: C16H17IN2O2 MolecularWeight: 396.22285

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C2=C(N1C(C)C)C(=O)C3=CC=CC=C3C2=O)C.[I-]

Isomeric SMILES

CC1=[N+](C2=C(N1C(C)C)C(=O)C3=CC=CC=C3C2=O)C.[I-]

InChI

InChI=1S/C16H17N2O2.HI/c1-9(2)18-10(3)17(4)13-14(18)16(20)12-8-6-5-7-11(12)15(13)19;/h5-9H,1-4H3;1H/q+1;/p-1