2-(4-chlorophenyl)-2-(pyridin-1-ium-1-ylmethyl)indene-1,3-dione iodide

Systemtic Name: 2-(4-chlorophenyl)-2-(pyridin-1-ium-1-ylmethyl)indene-1,3-dione iodide Openeye Name: 2-(4-chlorophenyl)-2-(pyridin-1-ium-1-ylmethyl)indane-1,3-dione iodide CAS Name: 2-(4-chlorophenyl)-2-(1-pyridin-1-iumylmethyl)indene-1,3-dione iodide IUPAC Name: 2-(4-chlorophenyl)-2-(pyridin-1-ium-1-ylmethyl)indene-1,3-dione iodide Traditional Name: 2-(4-chlorophenyl)-2-(pyridin-1-ium-1-ylmethyl)indane-1,3-quinone iodide Formula: C21H15ClINO2 MolecularWeight: 475.70677

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=[N+](C=C1)CC2(C(=O)C3=CC=CC=C3C2=O)C4=CC=C(C=C4)Cl.[I-]

Isomeric SMILES

C1=CC=[N+](C=C1)CC2(C(=O)C3=CC=CC=C3C2=O)C4=CC=C(C=C4)Cl.[I-]

InChI

InChI=1S/C21H15ClNO2.HI/c22-16-10-8-15(9-11-16)21(14-23-12-4-1-5-13-23)19(24)17-6-2-3-7-18(17)20(21)25;/h1-13H,14H2;1H/q+1;/p-1