2-[(1-ethylpyridin-1-ium-4-yl)methylidene]indene-1,3-dione iodide

Systemtic Name: 2-[(1-ethylpyridin-1-ium-4-yl)methylidene]indene-1,3-dione iodide Openeye Name: 2-[(1-ethylpyridin-1-ium-4-yl)methylene]indane-1,3-dione iodide CAS Name: 2-[(1-ethyl-4-pyridin-1-iumyl)methylidene]indene-1,3-dione iodide IUPAC Name: 2-[(1-ethylpyridin-1-ium-4-yl)methylidene]indene-1,3-dione iodide Traditional Name: 2-[(1-ethylpyridin-1-ium-4-yl)methylene]indane-1,3-quinone iodide Formula: C17H14INO2 MolecularWeight: 391.20303

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=CC=C(C=C1)C=C2C(=O)C3=CC=CC=C3C2=O.[I-]

Isomeric SMILES

CC[N+]1=CC=C(C=C1)C=C2C(=O)C3=CC=CC=C3C2=O.[I-]

InChI

InChI=1S/C17H14NO2.HI/c1-2-18-9-7-12(8-10-18)11-15-16(19)13-5-3-4-6-14(13)17(15)20;/h3-11H,2H2,1H3;1H/q+1;/p-1