1-ethyl-2-oxidanylidene-3-phenyl-5-pyridin-1-ium-1-yl-imidazole-4-carbaldehyde iodide

Systemtic Name: 1-ethyl-2-oxidanylidene-3-phenyl-5-pyridin-1-ium-1-yl-imidazole-4-carbaldehyde iodide Openeye Name: 1-ethyl-2-oxo-3-phenyl-5-pyridin-1-ium-1-yl-imidazole-4-carbaldehyde iodide CAS Name: 1-ethyl-2-oxo-3-phenyl-5-(1-pyridin-1-iumyl)-4-imidazolecarboxaldehyde iodide IUPAC Name: 1-ethyl-2-oxo-3-phenyl-5-pyridin-1-ium-1-ylimidazole-4-carbaldehyde iodide Traditional Name: 1-ethyl-2-keto-3-phenyl-5-pyridin-1-ium-1-yl-4-imidazoline-4-carbaldehyde iodide Formula: C17H16IN3O2 MolecularWeight: 421.23231

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(N(C1=O)C2=CC=CC=C2)C=O)[N+]3=CC=CC=C3.[I-]

Isomeric SMILES

CCN1C(=C(N(C1=O)C2=CC=CC=C2)C=O)[N+]3=CC=CC=C3.[I-]

InChI

InChI=1S/C17H16N3O2.HI/c1-2-19-16(18-11-7-4-8-12-18)15(13-21)20(17(19)22)14-9-5-3-6-10-14;/h3-13H,2H2,1H3;1H/q+1;/p-1