1-butyl-2-(phenylmethyl)pyrazol-2-ium iodide

Systemtic Name: 1-butyl-2-(phenylmethyl)pyrazol-2-ium iodide Openeye Name: 1-benzyl-2-butyl-pyrazol-1-ium iodide CAS Name: 1-butyl-2-(phenylmethyl)pyrazol-2-ium iodide IUPAC Name: 1-benzyl-2-butylpyrazol-1-ium iodide Traditional Name: 1-benzyl-2-butyl-pyrazol-1-ium iodide Formula: C14H19IN2 MolecularWeight: 342.21853

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C=CC=[N+]1CC2=CC=CC=C2.[I-]

Isomeric SMILES

CCCCN1C=CC=[N+]1CC2=CC=CC=C2.[I-]

InChI

InChI=1S/C14H19N2.HI/c1-2-3-10-15-11-7-12-16(15)13-14-8-5-4-6-9-14;/h4-9,11-12H,2-3,10,13H2,1H3;1H/q+1;/p-1