(1-methylquinolin-1-ium-7-yl) benzoate hydroiodide

Systemtic Name: (1-methylquinolin-1-ium-7-yl) benzoate hydroiodide Openeye Name: (1-methylquinolin-1-ium-7-yl) benzoate hydroiodide CAS Name: benzoic acid (1-methyl-7-quinolin-1-iumyl) ester hydroiodide IUPAC Name: (1-methylquinolin-1-ium-7-yl) benzoate hydroiodide Traditional Name: benzoic acid (1-methylquinolin-1-ium-7-yl) ester hydroiodide Formula: C17H15INO2+ MolecularWeight: 392.21097

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC=CC2=C1C=C(C=C2)OC(=O)C3=CC=CC=C3.I

Isomeric SMILES

C[N+]1=CC=CC2=C1C=C(C=C2)OC(=O)C3=CC=CC=C3.I

InChI

InChI=1S/C17H14NO2.HI/c1-18-11-5-8-13-9-10-15(12-16(13)18)20-17(19)14-6-3-2-4-7-14;/h2-12H,1H3;1H/q+1;