1-(1-methylpyridin-1-ium-4-yl)-3-(phenylmethyl)urea iodide

Systemtic Name: 1-(1-methylpyridin-1-ium-4-yl)-3-(phenylmethyl)urea iodide Openeye Name: 1-benzyl-3-(1-methylpyridin-1-ium-4-yl)urea iodide CAS Name: 1-(1-methyl-4-pyridin-1-iumyl)-3-(phenylmethyl)urea iodide IUPAC Name: 1-benzyl-3-(1-methylpyridin-1-ium-4-yl)urea iodide Traditional Name: 1-benzyl-3-(1-methylpyridin-1-ium-4-yl)urea iodide Formula: C14H16IN3O MolecularWeight: 369.20081

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC=C(C=C1)NC(=O)NCC2=CC=CC=C2.[I-]

Isomeric SMILES

C[N+]1=CC=C(C=C1)NC(=O)NCC2=CC=CC=C2.[I-]

InChI

InChI=1S/C14H15N3O.HI/c1-17-9-7-13(8-10-17)16-14(18)15-11-12-5-3-2-4-6-12;/h2-10H,11H2,1H3,(H,15,18);1H