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

Systemtic Name: 2-oxidanylidene-3-phenyl-1-prop-2-enyl-5-pyridin-1-ium-1-yl-imidazole-4-carbaldehyde iodide Openeye Name: 1-allyl-2-oxo-3-phenyl-5-pyridin-1-ium-1-yl-imidazole-4-carbaldehyde iodide CAS Name: 2-oxo-3-phenyl-1-prop-2-enyl-5-(1-pyridin-1-iumyl)-4-imidazolecarboxaldehyde iodide IUPAC Name: 2-oxo-3-phenyl-1-prop-2-enyl-5-pyridin-1-ium-1-ylimidazole-4-carbaldehyde iodide Traditional Name: 1-allyl-2-keto-3-phenyl-5-pyridin-1-ium-1-yl-4-imidazoline-4-carbaldehyde iodide Formula: C18H16IN3O2 MolecularWeight: 433.24301

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H16N3O2.HI/c1-2-11-20-17(19-12-7-4-8-13-19)16(14-22)21(18(20)23)15-9-5-3-6-10-15;/h2-10,12-14H,1,11H2;1H/q+1;/p-1