1-methyl-2-(5-phenyl-3,4-dihydropyrazol-2-yl)pyridin-1-ium iodide

Systemtic Name: 1-methyl-2-(5-phenyl-3,4-dihydropyrazol-2-yl)pyridin-1-ium iodide Openeye Name: 1-methyl-2-(5-phenyl-3,4-dihydropyrazol-2-yl)pyridin-1-ium iodide CAS Name: 1-methyl-2-(5-phenyl-3,4-dihydropyrazol-2-yl)pyridin-1-ium iodide IUPAC Name: 1-methyl-2-(5-phenyl-3,4-dihydropyrazol-2-yl)pyridin-1-ium iodide Traditional Name: 1-methyl-2-(3-phenyl-2-pyrazolin-1-yl)pyridin-1-ium iodide Formula: C15H16IN3 MolecularWeight: 365.21211

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC=CC=C1N2CCC(=N2)C3=CC=CC=C3.[I-]

Isomeric SMILES

C[N+]1=CC=CC=C1N2CCC(=N2)C3=CC=CC=C3.[I-]

InChI

InChI=1S/C15H16N3.HI/c1-17-11-6-5-9-15(17)18-12-10-14(16-18)13-7-3-2-4-8-13;/h2-9,11H,10,12H2,1H3;1H/q+1;/p-1